SCHEMBL3395703

SCHEMBL3395703

CCCCOC(=O)NC(N)=S

nearest known ligand 0.49

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 2/20 0.49
MAPT P10636 1/20 0.49
NPSR1 Q6W5P4 1/20 0.49
EPHX1 P07099 1/20 0.48
NPC1 O15118 1/20 0.47
SMN1; SMN2 Q16637 1/20 0.47
ACHE P22303 14/20 0.47
ALDH1A1 P00352 1/20 0.47
TAS2R38 P59533 1/20 0.45
ATM Q13315 1/20 0.44

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
SCHEMBL4451188 0.84 RAB9A (0.61) RAB9AMAPTNPSR1EPHX1NPC1
SCHEMBL590532 0.83 EPHX1 (0.59) RAB9AMAPTNPSR1EPHX1ACHE
SCHEMBL4430601 0.82 EPHX1 (0.50) RAB9AMAPTNPSR1EPHX1ACHE
SCHEMBL17443826 0.82 EPHX1 (0.50) RAB9AMAPTNPSR1EPHX1ACHE
SCHEMBL1126445 0.81 ACHE (0.52) RAB9AMAPTNPSR1EPHX1NPC1
SCHEMBL5160852 0.81 EPHX1 (0.48) RAB9AEPHX1NPC1SMN1; SMN2ACHE
SCHEMBL1233113 0.79
SCHEMBL9197261 0.79 EPHX1 (0.55) RAB9AMAPTNPSR1EPHX1ACHE
SCHEMBL5163094 0.79 EPHX1 (0.47) RAB9AEPHX1NPC1SMN1; SMN2ACHE
SCHEMBL8532896 0.79 EPHX1 (0.56) RAB9AMAPTEPHX1NPC1SMN1; 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 22 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3990455-A1 PROCESSES FOR PREPARING TOLL-LIKE RECEPTOR MODULATOR COMPOUNDS GILEAD SCIENCES, INC. (US) 2022-05-04 EP disclosed
WO-2020264081-A1 PROCESSES FOR PREPARING TOLL-LIKE RECEPTOR MODULATOR COMPOUNDS GILEAD SCIENCES, INC. (US) 2020-12-30 WO disclosed
WO-2015130445-A1 QUINOLINE DERIVATIVES USEFUL AS CB-1 INVERSE AGONISTS JANSSEN PHARMACEUTICA NV (BE) 2015-09-03 WO disclosed
WO-2015130444-A1 QUINOLINE DERIVATIVES USEFUL AS CB-1 INVERSE AGONISTS JANSSEN PHARMACEUTICA NV (BE) 2015-09-03 WO disclosed
EP-2785715-A1 SUBSTITUTED PYRIDINE DERIVATIVES AS FABI INHIBITORS Aurigene Discovery Technologies Limited (IN) 2014-10-08 EP disclosed
WO-2013080222-A1 SUBSTITUTED PYRIDINE DERIVATIVES AS FABI INHIBITORS AURIGENE DISCOVERY TECHNOLOGIES LIMITED (IN) 2013-06-06 WO disclosed
EP-2238134-A2 BIS-THIAZOLE DERIVATIVES, PROCESS FOR THEIR PREPARATION AND THEIR USE AS MEDICAMENTS Novartis AG (CH) 2010-10-13 EP disclosed
WO-2010025448-A2 INHIBITION OF CELL PROLIFERATION UNIVERSITY OF SOUTH FLORIDA (US) 2010-03-04 WO disclosed
WO-2009080705-A2 BIS-THIAZOLE DERIVATIVES, PROCESS FOR THEIR PREPARATION AND THEIR USE AS MEDICAMENTS NOVARTIS AG (CH) 2009-07-02 WO disclosed
EP-1989203-A2 ALPHA CARBOLINES AND USES THEREOF MILLENNIUM PHARMACEUTICALS, INC. (US) 2008-11-12 EP disclosed
US-20070078121-A1 Enzyme modulators and treatments DECIPHERA PHARMACEUTICALS, LLC 2007-04-05 US disclosed
WO-2006071940-A2 ENZYME MODULATORS AND TREATMENTS DECIPHERA PHARMACEUTICALS, LLC (US) 2006-07-06 WO disclosed
EP-1430074-A1 AMINOGLYCOSIDE LIPID DERIVATIVES FOR TRANSFECTION Aventis Pharma S.A. (FR) 2004-06-23 EP disclosed
EP-1385822-A1 AMINOPYRROLIDINE SULFONAMIDES AS SERINE PROTEASE INHIBITORS Ortho-McNeil Pharmaceutical, Inc. (US) 2004-02-04 EP disclosed
WO-2003018603-A1 AMINOGLYCOSIDE LIPID DERIVATIVES FOR TRANSFECTION AVENTIS PHARMA S.A. (FR) 2003-03-06 WO disclosed
WO-2002076945-A1 AMINOPYRROLIDINE SULFONAMIDES AS SERINE PROTEASE INHIBITORS ORTHO-MCNEIL PHARMACEUTICAL, INC. (US) 2002-10-03 WO disclosed
EP-0889877-A1 META-SUBSTITUTED PHENYLENE DERIVATIVES AND THEIR USE AS ALPHAvBETA3 INTEGRIN ANTAGONISTS OR INHIBITORS G.D. SEARLE & CO. (US) 1999-01-13 EP disclosed
EP-0876365-A1 SUBSTITUTED QUINOLYLMETHYLEN-OXINDOLE ANALOGUES AS TYROSINE KINASE INHIBITORS PHARMACIA & UPJOHN S.p.A. (IT) 1998-11-11 EP disclosed
WO-1997046551-A1 SUBSTITUTED QUINOLYLMETHYLEN-OXINDOLE ANALOGUES AS TYROSINE KINASE INHIBITORS PHARMACIA & UPJOHN S.P.A. (IT) 1997-12-11 WO disclosed
WO-1997036862-A1 META-SUBSTITUTED PHENYLENE DERIVATIVES AND THEIR USE AS ALPHAvBETA3 INTEGRIN ANTAGONISTS OR INHIBITORS G.D. SEARLE & CO. (US) 1997-10-09 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 (1 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-20070078121-A1 Enzyme modulators and treatments ABL1, ABL2, LCK RAB9A 2127/4885MAPT 3484/4885NPSR1 3680/4885

“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.