SCHEMBL22336342

SCHEMBL22336342

CC(C)CCC(=O)N[C@H](C(=O)N[C@@H](C)C(=O)Nc1ccc(CC(C)C)cc1)C(C)C

nearest known ligand 0.50

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ GAA P10253 1/20 0.46
▸ MAPT P10636 1/20 0.46
▸ CRHBP P24387 1/20 0.46
▸ CRHR2 Q13324 1/20 0.46
▸ SMN1; SMN2 Q16637 1/20 0.46
▸ CA12 O43570 1/20 0.42
▸ CA1 P00915 1/20 0.42
▸ CA2 P00918 1/20 0.42
▸ CA4 P22748 1/20 0.42
▸ CA9 Q16790 1/20 0.42
▸ TRPV1 Q8NER1 2/20 0.40

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
SCHEMBL22336344 1.00 GAA (0.46) GAAMAPTCRHBPCRHR2SMN1; SMN2
SCHEMBL21649720 0.91 GAA (0.46) GAAMAPTCRHBPCRHR2SMN1; SMN2
SCHEMBL22746497 0.91 GAA (0.46) GAAMAPTCRHBPCRHR2SMN1; SMN2
SCHEMBL25778035 0.91 NAMPT (0.38) —
SCHEMBL22854052 0.88 GAA (0.45) GAAMAPTCRHBPCRHR2SMN1; SMN2
SCHEMBL22854024 0.88 GAA (0.45) GAAMAPTCRHBPCRHR2SMN1; SMN2
SCHEMBL26445322 0.87 GAA (0.44) GAAMAPTCRHBPCRHR2SMN1; SMN2
SCHEMBL22336359 0.84 GAA (0.41) GAAMAPTCRHBPCRHR2SMN1; SMN2
SCHEMBL22746401 0.84 GAA (0.41) GAAMAPTCRHBPCRHR2SMN1; SMN2
SCHEMBL24869079 0.83 MEN1 (0.40) SMN1; SMN2

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 8 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20220249683-A1 T-CELL DEPLETING THERAPIES HEIDELBERG PHARMA RESEARCH GMBH (DE) 2022-08-11 — — US disclosed
US-20220177575-A1 ANTI-CD117 ANTIBODIES AND USES THEREOF Magenta Therapeutics, Inc. 2022-06-09 — — US disclosed
US-20220177578-A1 ANTI-CD117 ANTIBODIES AND USES THEREOF Magenta Therapeutics, Inc. 2022-06-09 — — US disclosed
US-20210371524-A1 ANTI-CD45 ANTIBODIES AND CONJUGATES THEREOF REGENERON PHARMACEUTICALS, INC. 2021-12-02 — — US disclosed
US-20210228696-A1 USE OF ANTI-CD137 ANTIBODY DRUG CONJUGATE (ADC) IN ALLOGENEIC CELL THERAPY HEIDELBERG PHARMA RESEARCH GMBH (DE) 2021-07-29 — — US disclosed
US-20200407440-A1 AMATOXIN ANTIBODY-DRUG CONJUGATES AND USES THEREOF MAGENTA THERAPEUTICS INC (US) 2020-12-31 — — US disclosed
US-20200376135-A1 FC SILENCED ANTIBODY DRUG CONJUGATES (ADCS) AND USES THEREOF Magenta Therapeutics, Inc. (US) 2020-12-03 — — US disclosed
US-20200255523-A1 FC SILENCED ANTIBODY DRUG CONJUGATES (ADCS) AND USES THEREOF REGENERON PHARMACEUTICALS, INC. 2020-08-13 — — US 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 (8 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-20220177575-A1 ANTI-CD117 ANTIBODIES AND USES THEREOF MYADM, SIGLEC7, ITGB7 GAA 779/4885MAPT 4561/4885CRHBP 4278/4885
US-20200407440-A1 AMATOXIN ANTIBODY-DRUG CONJUGATES AND USES THEREOF MYADM, FUT7, SIGLEC7 GAA 572/4885MAPT 3537/4885CRHBP 4038/4885
US-20210228696-A1 USE OF ANTI-CD137 ANTIBODY DRUG CONJUGATE (ADC) IN ALLOGENEIC CELL THERAPY CD40LG, CD44, CD74 GAA 732/4885MAPT 3019/4885CRHBP 1738/4885
US-20200255523-A1 FC SILENCED ANTIBODY DRUG CONJUGATES (ADCS) AND USES THEREOF FCGR1A, FCGR2A, FCGR3B GAA 1194/4885MAPT 4451/4885CRHBP 4103/4885
US-20210371524-A1 ANTI-CD45 ANTIBODIES AND CONJUGATES THEREOF CD44, LY6K, CD2 GAA 351/4885MAPT 2706/4885CRHBP 3970/4885
US-20220177578-A1 ANTI-CD117 ANTIBODIES AND USES THEREOF MYADM, SIGLEC7, ITGB7 GAA 779/4885MAPT 4561/4885CRHBP 4278/4885
US-20200376135-A1 FC SILENCED ANTIBODY DRUG CONJUGATES (ADCS) AND USES THEREOF FCGR1A, FCGR2A, FCGR3B GAA 1194/4885MAPT 4451/4885CRHBP 4103/4885
US-20220249683-A1 T-CELL DEPLETING THERAPIES CD2, CD4, CD22 GAA 3378/4885MAPT 2378/4885CRHBP 4634/4885

“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.

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