SCHEMBL962353

SCHEMBL962353

Cc1ccc(S(=O)(=O)OCC2CCC(F)(F)CC2)cc1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP2D6 P10635 4/20 0.39
CYP1A2 P05177 1/20 0.39
KMT2A Q03164 2/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
STAT3 P40763 1/20 0.36
SCN9A Q15858 3/20 0.36
SCN5A Q14524 1/20 0.36
ALDH1A1 P00352 5/20 0.35
CYP3A4 P08684 3/20 0.35
TSHR P16473 3/20 0.35
CYP2C9 P11712 2/20 0.35
CYP2C19 P33261 1/20 0.35
MAPT P10636 1/20 0.35
MAPK1 P28482 1/20 0.35
CRBN Q96SW2 1/20 0.35
GAA P10253 1/20 0.35
ACHE P22303 1/20 0.35
MEN1 O00255 1/20 0.35
TP53 P04637 1/20 0.35
POLB P06746 1/20 0.35

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
SCHEMBL18372671 0.92 CYP2D6 (0.37) CYP2D6CYP1A2KMT2ASMN1; SMN2STAT3
SCHEMBL23151947 0.87 CYP2D6 (0.40) CYP2D6CYP1A2KMT2ASMN1; SMN2STAT3
SCHEMBL7166740 0.86 CYP2D6 (0.45) CYP2D6CYP1A2KMT2ASTAT3ALDH1A1
SCHEMBL7032005 0.86 CYP2D6 (0.45) CYP2D6CYP1A2KMT2ASTAT3ALDH1A1
SCHEMBL26655167 0.86 CYP2D6 (0.45) CYP2D6CYP1A2KMT2ASTAT3ALDH1A1
SCHEMBL26655196 0.86 CYP2D6 (0.45) CYP2D6CYP1A2KMT2ASTAT3ALDH1A1
SCHEMBL17006 0.86 CYP2D6 (0.37) CYP2D6CYP1A2KMT2ASMN1; SMN2STAT3
SCHEMBL3518969 0.86 CYP2D6 (0.37) CYP2D6CYP1A2KMT2ASMN1; SMN2STAT3
SCHEMBL2304680 0.85 STAT3 (0.38) CYP2D6CYP1A2KMT2ASMN1; SMN2STAT3
SCHEMBL25307250 0.84 CYP2D6 (0.40) CYP2D6CYP1A2KMT2ASMN1; SMN2STAT3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4624465-A1 COMPOUND SERVING AS DDR1 KINASE INHIBITOR, AND MEDICINE Nippon Shinyaku Co., Ltd. (JP) 2025-10-01 EP disclosed
US-20250011331-A1 HPK1 ANTAGONISTS AND USES THEREOF SCHRÖDINGER, INC. 2025-01-09 US disclosed
EP-4380565-A1 HPK1 ANTAGONISTS AND USES THEREOF Nimbus Saturn, Inc. (US) 2024-06-12 EP disclosed
US-11999699-B2 Substituted pyrazole amides Grünenthal GmbH (DE) 2024-06-04 US disclosed
WO-2024111560-A1 COMPOUND SERVING AS DDR1 KINASE INHIBITOR, AND MEDICINE 日本新薬株式会社 2024-05-30 WO disclosed
WO-2023015199-A1 HPK1 ANTAGONISTS AND USES THEREOF Nimbus Saturn, Inc. (US) 2023-02-09 WO disclosed
US-20230025025-A1 SUBSTITUTED PYRAZOLE AMIDES GRUENENTHAL GMBH (DE) 2023-01-26 US disclosed
US-9822109-B2 Heterocyclic compounds and uses thereof PLEXXIKON INC. (US) 2017-11-21 US disclosed
EP-2024349-B1 COMPOUNDS AS CANNABINOID RECEPTOR LIGANDS AND USES THEREOF ABBVIE INC (US) 2017-08-02 EP disclosed
CN-102574812-B Novel benzimidazole derivatives and their use as FXR agonists HOFFMAN-LA ROCHE LTD. (CH) 2016-03-30 CN disclosed
US-20080064699-A1 Such as N-[3-(2-methoxyethyl)-1,3-thiazol-2(3H)-ylidene]adamantane-1-carboxamide; neuropathic, nociceptive and/or inflammatory pain; neuroprotection ABBVIE INC. 2008-03-13 US disclosed
US-20070112068-A1 Nitrile compound and its use in pest control SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2007-05-17 US disclosed
US-20070112068-A1 Nitrile compound and its use in pest control SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2007-05-17 US disclosed
US-20070112068-A1 Nitrile compound and its use in pest control SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2007-05-17 US disclosed
CN-1898200-A Nitrile compound and its pest control use SUMITOMO CHEMICAL CO (JP) 2007-01-17 CN disclosed
EP-1697311-A1 NITRILE COMPOUND AND ITS USE IN PEST CONTROL Sumitomo Chemical Company, Limited (JP) 2006-09-06 EP disclosed
WO-2005063694-A1 NITRILE COMPOUND AND ITS USE IN PEST CONTROL SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2005-07-14 WO disclosed
EP-0775132-B1 (AZETIDIN-1-YLALKYL)LACTAMS AS TACHYKININ ANTAGONISTS PFIZER LTD (GB) 2001-03-28 EP disclosed
US-5968923-A ANTIINFLAMMATORY AGENTS, TREATMENT OF NERVOUS SYSTEM DISORDERS, GASTROINTESTINAL DISORDERS PFIZER INC. (US) 1999-10-19 US disclosed
WO-1996005193-A1 (AZETIDIN-1-YLALKYL)LACTAMS AS TACHYKININ ANTAGONISTS PFIZER LIMITED (GB) 1996-02-22 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 (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-20250011331-A1 HPK1 ANTAGONISTS AND USES THEREOF PDXK, HIPK1, PCK1 CYP2D6 4183/4885CYP1A2 3908/4885KMT2A 2422/4885
US-11999699-B2 Substituted pyrazole amides SCN8A, SCN1A, SCN7A CYP2D6 324/4885CYP1A2 309/4885KMT2A 2357/4885
US-20070112068-A1 Nitrile compound and its use in pest control C5, C9, C1S CYP2D6 265/4885CYP1A2 124/4885KMT2A 2002/4885
US-20080064699-A1 Such as N-[3-(2-methoxyethyl)-1,3-thiazol-2(3H)-ylidene]adamantane-1-carboxamide; neuropathic, nociceptive and/or inflammatory pain; neuroprotection OPRL1, OPRK1, OPRD1 CYP2D6 520/4885CYP1A2 309/4885KMT2A 2711/4885
US-20230025025-A1 SUBSTITUTED PYRAZOLE AMIDES SCN8A, SCN1A, SCN7A CYP2D6 324/4885CYP1A2 309/4885KMT2A 2357/4885

“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.