SCHEMBL496716

SCHEMBL496716

O=S(=O)(O)Cc1ccc(C(F)(F)F)cc1

nearest known ligand 0.59

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
KIF11 P52732 1/20 0.59
KMT2A Q03164 1/20 0.50
BCHE P06276 1/20 0.46
ACHE P22303 1/20 0.46
TAAR1 Q96RJ0 1/20 0.45
IDO1 P14902 4/20 0.44
CYP19A1 P11511 1/20 0.44
CES2 O00748 1/20 0.43
CES1 P23141 1/20 0.43
SRD5A2 P31213 1/20 0.43
ACLY P53396 1/20 0.42
CA1 P00915 2/20 0.41
CA2 P00918 2/20 0.41
CA9 Q16790 1/20 0.41
PTPN1 P18031 1/20 0.41
GSK3B P49841 1/20 0.41

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
Hydrochloric Acid SCHEMBL28126261 0.98 KIF11 (0.58) KIF11KMT2ABCHEACHETAAR1
SCHEMBL8474031 0.82 CA2 (0.41) KIF11KMT2ACA1CA2CA9
SCHEMBL16140113 0.81 KIF11 (0.61) KIF11KMT2ABCHEACHETAAR1
SCHEMBL28421458 0.80 HSD11B1 (0.53)
SCHEMBL27767638 0.80 KIF11 (0.40) KIF11KMT2ABCHEACHECA1
SCHEMBL496729 0.79 ACP1 (0.50) KIF11IDO1CES2CA1CA2
SCHEMBL28947649 0.79 KIF11 (0.38) KIF11KMT2ACA1CA2CA9
SCHEMBL2375555 0.79 KIF11 (0.59) KIF11KMT2ABCHEACHETAAR1
SCHEMBL9284 0.79 KIF11 (0.59) KIF11KMT2ABCHEACHETAAR1
SCHEMBL496730 0.79 BCHE (0.47) BCHEACHECA1CA2

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 26 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2578577-A1 Sulfonyl esters of tetrahydrocannabinol and derivatives thereof Albany Molecular Research, Inc. (US) 2013-04-10 EP claimed
US-7674922-B2 Process for production of delta-9-tetrahydrocannabinol ALBANY MOLECULAR RESEARCH, INC. (US) 2010-03-09 US claimed
EP-1928853-A2 PROCESS FOR PRODUCTION OF DELTA-9-TETRAHYDROCANNABINOL AMR Technology, Inc. (US) 2008-06-11 EP claimed
US-20070093665-A1 Process for production of delta-9- tetrahydrocannabinol AMR TECHNOLOGY, INC. (US) 2007-04-26 US claimed
WO-2007041167-A2 PROCESS FOR PRODUCTION OF DELTA-9-TETRAHYDROCANNABINOL AMR TECHNOLOGY, INC. (US) 2007-04-12 WO claimed
US-11897857-B2 Isotopically-stabilized tetronimide compounds MIDWESTERN UNIVERSITY (US) 2024-02-13 US disclosed
CN-114502540-A TEAD inhibitors and uses thereof 医肯纳肿瘤学公司 2022-05-13 CN disclosed
US-20210094927-A1 ISOTOPICALLY-STABILIZED TETRONIMIDE COMPOUNDS MIDWESTERN UNIVERSITY 2021-04-01 US disclosed
US-10961211-B2 Isotopically-stabilized tetronimide compounds MIDWESTERN UNIVERSITY (US) 2021-03-30 US disclosed
US-20200262804-A1 Isotopically-Stabilized Tetronimide Compounds MIDWESTERN UNIVERSITY 2020-08-20 US disclosed
WO-2020054287-A1 PEPTIDE PURIFICATION METHOD USING SULFONATE COMPOUND 長瀬産業株式会社 2020-03-19 WO disclosed
US-9354523-B2 Composition for resist pattern-refinement, and fine pattern-forming method JSR CORPORATION (JP) 2016-05-31 US disclosed
US-7674922-B2 Process for production of delta-9-tetrahydrocannabinol ALBANY MOLECULAR RESEARCH, INC. (US) 2010-03-09 US disclosed
EP-1928853-A2 PROCESS FOR PRODUCTION OF DELTA-9-TETRAHYDROCANNABINOL AMR Technology, Inc. (US) 2008-06-11 EP disclosed
US-20070093665-A1 Process for production of delta-9- tetrahydrocannabinol AMR TECHNOLOGY, INC. (US) 2007-04-26 US disclosed
WO-2007041167-A2 PROCESS FOR PRODUCTION OF DELTA-9-TETRAHYDROCANNABINOL AMR TECHNOLOGY, INC. (US) 2007-04-12 WO disclosed
EP-1718605-A1 PROCESSES FOR THE PREPARATION OF ARYL-AND HETEROARYL-ALKYLSULFONYL HALIDES Wyeth (US) 2006-11-08 EP disclosed
WO-2005082843-A1 PROCESSES FOR THE PREPARATION OF ARYL-AND HETEROARYL-ALKYLSULFONYL HALIDES WYETH (US) 2005-09-09 WO disclosed
CN-1024887-C 2-phenylimidazole derivative-containing pesticide MAY & BAKER LTD (GB) 1994-06-08 CN disclosed
CN-1030577-A Disinsection method with 2-phenylimidazole derivative MAY & BAKER CO LTD (GB) 1989-01-25 CN 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 (5 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-11897857-B2 Isotopically-stabilized tetronimide compounds ASPH, BACE1, DNPEP KIF11 2908/4885KMT2A 737/4885BCHE 63/4885
US-10961211-B2 Isotopically-stabilized tetronimide compounds ASPH, BACE1, DNPEP KIF11 2908/4885KMT2A 737/4885BCHE 63/4885
US-20200262804-A1 Isotopically-Stabilized Tetronimide Compounds ASPH, BACE1, DNPEP KIF11 2908/4885KMT2A 737/4885BCHE 63/4885
US-20070093665-A1 Process for production of delta-9- tetrahydrocannabinol CNR2, CNR1, HRH4 KIF11 1729/4885KMT2A 2043/4885BCHE 1254/4885
US-20210094927-A1 ISOTOPICALLY-STABILIZED TETRONIMIDE COMPOUNDS ASPH, BACE1, DNPEP KIF11 2908/4885KMT2A 737/4885BCHE 63/4885

“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.