SCHEMBL538191

SCHEMBL538191

CCOC(=O)c1cnc2ccc(F)cc2c1Cl

nearest known ligand 0.60

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
NMT2 O60551 1/20 0.60
NMT1 P30419 1/20 0.60
MAPT P10636 4/20 0.57
NPSR1 Q6W5P4 2/20 0.57
KDM4E B2RXH2 2/20 0.57
GAA P10253 2/20 0.57
ATM Q13315 1/20 0.57
L3MBTL1 Q9Y468 1/20 0.57
LMNA P02545 1/20 0.55
SMN1; SMN2 Q16637 1/20 0.55
MEN1 O00255 4/20 0.55
KMT2A Q03164 4/20 0.55
ALDH1A1 P00352 1/20 0.55
TSHR P16473 1/20 0.54
MAPK10 P53779 1/20 0.51
MAPK1 P28482 2/20 0.49

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
SCHEMBL30900720 1.00 NMT2 (0.60) NMT2NMT1MAPTNPSR1KDM4E
SCHEMBL621104 0.90 KMT2A (0.55) NMT2NMT1MAPTNPSR1KDM4E
SCHEMBL1367417 0.87 MEN1 (0.65) NMT2NMT1MAPTNPSR1KDM4E
SCHEMBL1467189 0.87 MAPK1 (0.63) NMT1MAPTNPSR1KDM4EGAA
SCHEMBL538115 0.86 NMT1 (0.61) NMT2NMT1MAPTNPSR1KDM4E
SCHEMBL27720570 0.86 MAPT (0.54) MAPTNPSR1KDM4EGAAL3MBTL1
SCHEMBL401916 0.85 MAPK1 (0.65) MAPTNPSR1KDM4EGAAATM
SCHEMBL22395756 0.85 NMT2 (0.60) NMT2NMT1MAPTNPSR1KDM4E
SCHEMBL3881231 0.85 MEN1 (0.53) NMT1MAPTNPSR1KDM4EGAA
SCHEMBL439008 0.85 NMT2 (0.60) NMT2NMT1MAPTNPSR1KDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4155300-B1 SUBSTITUTED QUINOLINE ANALOGS AS ALDEHYDE DEHYDROGENASE 1A1 (ALDH1A1) INHIBITORS US HEALTH (US) 2026-02-11 EP disclosed
CN-120129538-A Compounds and uses thereof 伦敦国王学院 2025-06-10 CN disclosed
EP-4511114-A1 HETEROARYL COMPOUNDS FOR THE TREATMENT OF PAIN Vertex Pharmaceuticals Incorporated (US) 2025-02-26 EP disclosed
WO-2024100095-A1 COMPOUNDS AND THEIR USE KING’S COLLEGE LONDON (GB) 2024-05-16 WO disclosed
WO-2024100095-A1 COMPOUNDS AND THEIR USE KING’S COLLEGE LONDON (GB) 2024-05-16 WO disclosed
EP-3704102-B1 SUBSTITUTED QUINOLINE ANALOGS AS ALDEHYDE DEHYDROGENASE 1A1 (ALDH1A1) INHIBITORS US HEALTH (US) 2024-02-28 EP disclosed
EP-3704102-B1 SUBSTITUTED QUINOLINE ANALOGS AS ALDEHYDE DEHYDROGENASE 1A1 (ALDH1A1) INHIBITORS US HEALTH (US) 2024-02-28 EP disclosed
US-20230382910-A1 HETEROARYL COMPOUNDS FOR THE TREATMENT OF PAIN VERTEX PHARMACEUTICALS INCORPORATED 2023-11-30 US disclosed
US-20230382910-A1 HETEROARYL COMPOUNDS FOR THE TREATMENT OF PAIN VERTEX PHARMACEUTICALS INCORPORATED 2023-11-30 US disclosed
US-20230382910-A1 HETEROARYL COMPOUNDS FOR THE TREATMENT OF PAIN VERTEX PHARMACEUTICALS INCORPORATED 2023-11-30 US disclosed
WO-2007051982-A1 TRIAZOLE COMPOUNDS AS LIPOXYGENASE INHIBITORS BIOLIPOX AB (SE) 2007-05-10 WO disclosed
EP-1603883-A2 QUINOLINE-DERIVED AMIDE MODULATORS OF VANILLOID VR1 RECEPTOR JANSSEN PHARMACEUTICA N.V. (BE) 2005-12-14 EP disclosed
US-20040192728-A1 Quinoline-derived amide modulators of vanilloid VR1 receptor JANSSEN PHARMACEUTICA N.V. (BE) 2004-09-30 US disclosed
WO-2004069792-A2 QUINOLINE-DERIVED AMIDE MODULATORS OF VANILLOID VR1 RECEPTOR JANSSEN PHARMACEUTICA N.V. (US) 2004-08-19 WO disclosed
WO-1999006401-A1 2-ARYL-2,5-DIHYDRO-PYRAZOLO[4,3-c]QUINOLIN-3-ONES AS GABA ALPHA 5 RECEPTOR INVERSE AGONISTS MERCK SHARP & DOHME LIMITED (GB) 1999-02-11 WO disclosed
EP-0182165-B1 THIENYL CONDENSED-PYRAZOLE DERIVATIVES SHIONOGI & CO., LTD. (JP) 1989-08-16 EP disclosed
US-4690930-A TRANQUILIZERS, ANTICONVULSANTS SHIONOGI & CO., LTD (JP) 1987-09-01 US disclosed
EP-0182165-A1 Thienyl condensed-pyrazole derivatives SHIONOGI & CO., LTD. (JP) 1986-05-28 EP disclosed
US-4524146-A NERVOUS SYSTEM DISORDERS CIBA-GEIGY CORPORATION (US) 1985-06-18 US disclosed
US-4312870-A TRANQUILIZERS, ANTIDEPRESSANTS CIBA-GEIGY CORPORATION (US) 1982-01-26 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 (2 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-20230382910-A1 HETEROARYL COMPOUNDS FOR THE TREATMENT OF PAIN TRPV1, SCN3A, KCNN3 NMT2 949/4885NMT1 1758/4885MAPT 2089/4885
US-20040192728-A1 Quinoline-derived amide modulators of vanilloid VR1 receptor TRPV1, OPRL1, TRPV2 NMT2 1902/4885NMT1 1394/4885MAPT 4519/4885

“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.