SCHEMBL9795481

SCHEMBL9795481

Cc1nc(OCc2cccc(C(F)(F)F)c2)c(C(=O)Cl)s1

nearest known ligand 0.49

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ MAOB P27338 5/20 0.49
▸ NR4A2 P43354 2/20 0.47
▸ L3MBTL1 Q9Y468 2/20 0.47
▸ ALDH1A1 P00352 1/20 0.47
▸ GAA P10253 1/20 0.47
▸ MAPT P10636 3/20 0.47
▸ HTT P42858 1/20 0.47
▸ FFAR4 Q5NUL3 2/20 0.46
▸ THRA P10827 1/20 0.45
▸ THRB P10828 1/20 0.45
▸ FFAR1 O14842 1/20 0.45
▸ MRGPRX4 Q96LA9 2/20 0.44
▸ CSNK1D P48730 1/20 0.43
▸ MAOA P21397 1/20 0.43
▸ HTR6 P50406 1/20 0.43
▸ POLB P06746 1/20 0.42
▸ PDGFRA P16234 1/20 0.42
▸ S1PR1 P21453 1/20 0.42
▸ S1PR5 Q9H228 1/20 0.42

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
SCHEMBL9795392 0.90 NR4A2 (0.54) MAOBNR4A2L3MBTL1ALDH1A1GAA
SCHEMBL9795318 0.87 MAPT (0.54) MAOBNR4A2L3MBTL1ALDH1A1GAA
SCHEMBL9852638 0.85 MAOB (0.47) MAOBNR4A2L3MBTL1ALDH1A1GAA
SCHEMBL9795357 0.83 MRGPRX4 (0.50) NR4A2L3MBTL1ALDH1A1GAAMAPT
SCHEMBL9795365 0.81 CYP1A2 (0.49) L3MBTL1ALDH1A1MAPTHTT
SCHEMBL9876508 0.77 NR4A2 (0.45) MAOBNR4A2L3MBTL1ALDH1A1GAA
SCHEMBL3455065 0.72 TRPM8 (0.52) MAOBL3MBTL1ALDH1A1MAPTHTT
SCHEMBL14014032 0.71 NR4A2 (0.78) MAOBNR4A2L3MBTL1MAPTHTT
SCHEMBL9405203 0.70 PRKCA (0.63) MAOBNR4A2L3MBTL1ALDH1A1MAPT
SCHEMBL15119869 0.70 NR4A2 (0.51) MAOBNR4A2L3MBTL1MAPTHTT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5057142-A Herbicidal thiazolecarboxamide derivatives BAYER AKTIENGESELLSCHAFT (DE) 1991-10-15 — — US disclosed
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