SCHEMBL3726700

SCHEMBL3726700

[CH2]CC(CC)CS(=O)(=O)O

nearest known ligand 0.34

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
SLC22A6 Q4U2R8 2/20 0.34

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL6721936 0.85 SLC22A6 (0.40) SLC22A6
SCHEMBL125768 0.82 SLC22A6 (0.39) SLC22A6
SCHEMBL28348920 0.76 CA2 (0.39) SLC22A6
SCHEMBL19677544 0.73 SLC22A6 (0.32) SLC22A6
SCHEMBL12108913 0.73 TSHR (0.38) SLC22A6
SCHEMBL23752256 0.73 ALDH1A1 (0.52)
SCHEMBL438255 0.73 ALDH1A1 (0.52)
SCHEMBL17450053 0.73 SLC22A6 (0.32) SLC22A6
SCHEMBL7053481 0.73 SLC22A6 (0.48) SLC22A6
SCHEMBL8810590 0.71 TP53 (0.48)

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 20 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240156766-A1 INJECTABLE MELPHALAN COMPOSITIONS COMPRISING A CYCLODEXTRIN DERIVATIVE AND METHODS OF MAKING AND USING THE SAME CYDEX PHARMACEUTICALS, INC. (US) 2024-05-16 US disclosed
US-20240139137-A1 Injectable Nitrogen Mustard Compositions Comprising a Cyclodextrin Derivative and Methods of Making and Using the Same CYDEX PHARMACEUTICALS, INC. 2024-05-02 US disclosed
EP-4274561-A1 PHARMACEUTICAL COMPOSITIONS OF CHEMOTHERAPEUTIC AGENTS BASED ON BETA-SUBSTITUTED BETA-AMINO ACID DERIVATIVES Quadriga Biosciences, Inc. (US) 2023-11-15 EP disclosed
US-20230348631-A1 PHARMACEUTICAL COMPOSITIONS OF CHEMOTHERAPEUTIC AGENTS BASED ON BETA-SUBSTITUTED BETA-AMINO ACID DERIVATIVES QUADRIGA BIOSCIENCES, INC. 2023-11-02 US disclosed
CN-116847855-A Pharmaceutical composition of chemotherapeutic agents based on beta-substituted beta-amino acid derivatives 夸德里加生物科学公司 2023-10-03 CN disclosed
WO-2022147743-A1 PHARMACEUTICAL COMPOSITIONS OF CHEMOTHERAPEUTIC AGENTS BASED ON BETA-SUBSTITUTED BETA-AMINO ACID DERIVATIVES QUADRIGA BIOSCIENCES, INC. (US) 2022-07-14 WO disclosed
WO-2022148456-A1 PHARMACEUTICAL COMPOSITIONS OF CHEMOTHERAPEUTIC AGENTS BASED ON BETA-SUBSTITUTED BETA-AMINO ACID DERIVATIVES QUADRIGA BIOSCIENCES, INC. (US) 2022-07-14 WO disclosed
US-20210379000-A1 INJECTABLE MELPHALAN COMPOSITIONS COMPRISING A CYCLODEXTRIN DERIVATIVE AND METHODS OF MAKING AND USING THE SAME CITIBANK, N.A., AS ADMINISTRATIVE AGENT 2021-12-09 US disclosed
US-11020363-B2 Injectable nitrogen mustard compositions comprising a cyclodextrin derivative and methods of making and using the same CYDEX PHARMACEUTICALS, INC. (US) 2021-06-01 US disclosed
US-10940128-B2 Injectable melphalan compositions comprising a cyclodextrin derivative and methods of making and using the same CYDEX PHARMACEUTICALS, INC. (US) 2021-03-09 US disclosed
US-20210046033-A1 Injectable Nitrogen Mustard Compositions Comprising a Cyclodextrin Derivative and Methods of Making and Using the Same CYDEX PHARMACEUTICALS, INC. 2021-02-18 US disclosed
US-10864183-B2 Injectable nitrogen mustard compositions comprising a cyclodextrin derivative and methods of making and using the same CYDEX PHARMACEUTICALS, INC. (US) 2020-12-15 US disclosed
US-20200268698-A1 Injectable Nitrogen Mustard Compositions Comprising a Cyclodextrin Derivative and Methods of Making and Using the Same CITIBANK, N.A., AS ADMINISTRATIVE AGENT 2020-08-27 US disclosed
EP-3100728-B1 PHARMACEUTICAL COMPOSITIONS COMPRISING PRASUGREL AND CYCLODEXTRIN DERIVATIVES AND METHODS OF MAKING AND USING THE SAME CYDEX PHARMACEUTICALS INC (US) 2019-11-20 EP disclosed
EP-2434886-B1 INJECTABLE MELPHALAN COMPOSITIONS COMPRISING A CYCLODEXTRIN DERIVATIVE AND METHODS OF MAKING AND USING THE SAME CYDEX PHARMACEUTICALS INC (US) 2019-10-16 EP disclosed
CN-106389307-A INJECTABLE MELPHALAN COMPOSITIONS COMPRISING A CYCLODEXTRIN DERIVATIVE AND METHODS OF MAKING AND USING THE SAME 锡德克斯药物公司 2017-02-15 CN disclosed
US-20140221488-A1 Injectable Melphalan Compositions Comprising a Cyclodextrin Derivative and Methods of Making and Using the Same CYDEX PHARMACEUTICALS, INC. (US) 2014-08-07 US disclosed
US-20140213650-A1 Injectable Nitrogen Mustard Compositions Comprising a Cyclodextrin Derivative and Methods of Making and Using the Same CYDEX PHARMACEUTICALS, INC. (US) 2014-07-31 US disclosed
US-20100311838-A1 Injectable Melphalan Compositions Comprising a Cyclodextrin Derivative and Methods of Making and Using the Same CYDEX PHARMACEUTICALS, INC. 2010-12-09 US disclosed
WO-2010138920-A1 INJECTABLE MELPHALAN COMPOSITIONS COMPRISING A CYCLODEXTRIN DERIVATIVE AND METHODS OF MAKING AND USING THE SAME CYDEX PHARMACEUTICALS, INC. (US) 2010-12-02 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (12 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20230348631-A1 PHARMACEUTICAL COMPOSITIONS OF CHEMOTHERAPEUTIC AGENTS BASED ON BETA-SUBSTITUTED BETA-AMINO ACID DERIVATIVES BCAT1, BCAT2, DDC SLC22A6 160/4885
US-10940128-B2 Injectable melphalan compositions comprising a cyclodextrin derivative and methods of making and using the same MCL1, MYADM, IL2 SLC22A6 388/4885
US-11020363-B2 Injectable nitrogen mustard compositions comprising a cyclodextrin derivative and methods of making and using the same GYS2, NOTUM, PYGL SLC22A6 222/4885
US-20200268698-A1 Injectable Nitrogen Mustard Compositions Comprising a Cyclodextrin Derivative and Methods of Making and Using the Same GYS2, NOTUM, PYGL SLC22A6 222/4885
US-20100311838-A1 Injectable Melphalan Compositions Comprising a Cyclodextrin Derivative and Methods of Making and Using the Same MCL1, MYADM, IL2 SLC22A6 388/4885
US-20140221488-A1 Injectable Melphalan Compositions Comprising a Cyclodextrin Derivative and Methods of Making and Using the Same MCL1, MYADM, IL2 SLC22A6 388/4885
US-20210046033-A1 Injectable Nitrogen Mustard Compositions Comprising a Cyclodextrin Derivative and Methods of Making and Using the Same GYS2, NOTUM, PYGL SLC22A6 222/4885
US-20210379000-A1 INJECTABLE MELPHALAN COMPOSITIONS COMPRISING A CYCLODEXTRIN DERIVATIVE AND METHODS OF MAKING AND USING THE SAME MCL1, MYADM, IL2 SLC22A6 388/4885
US-20240156766-A1 INJECTABLE MELPHALAN COMPOSITIONS COMPRISING A CYCLODEXTRIN DERIVATIVE AND METHODS OF MAKING AND USING THE SAME MCL1, MYADM, IL2 SLC22A6 388/4885
US-10864183-B2 Injectable nitrogen mustard compositions comprising a cyclodextrin derivative and methods of making and using the same GYS2, NOTUM, PYGL SLC22A6 222/4885
US-20140213650-A1 Injectable Nitrogen Mustard Compositions Comprising a Cyclodextrin Derivative and Methods of Making and Using the Same GYS2, NOTUM, PYGL SLC22A6 222/4885
US-20240139137-A1 Injectable Nitrogen Mustard Compositions Comprising a Cyclodextrin Derivative and Methods of Making and Using the Same GYS2, NOTUM, PYGL SLC22A6 222/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.