SCHEMBL6916580

SCHEMBL6916580

CO[SiH](CCc1ccc(S)cc1)OC

nearest known ligand 0.32

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
SIGMAR1 Q99720 1/20 0.32
TAAR1 Q96RJ0 1/20 0.32
HRH3 Q9Y5N1 1/20 0.31
IDO1 P14902 1/20 0.30
GSK3A P49840 1/20 0.30
GSK3B P49841 1/20 0.30

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
SCHEMBL17937777 0.79 TAAR1 (0.45) TAAR1IDO1
SCHEMBL17937573 0.79 TAAR1 (0.45) TAAR1IDO1
SCHEMBL296206 0.78 ALDH1A1 (0.42) TAAR1IDO1
SCHEMBL2169034 0.75 ALDH1A1 (0.41) SIGMAR1
SCHEMBL15739087 0.75 TAAR1 (0.50) TAAR1IDO1
SCHEMBL11812293 0.71 NR3C1 (0.39) SIGMAR1TAAR1IDO1
SCHEMBL331040 0.71 GFER (0.47) TAAR1IDO1
SCHEMBL2199847 0.69 CYP1A2 (0.43) TAAR1HRH3IDO1
SCHEMBL17937646 0.68 TAAR1 (0.42) SIGMAR1TAAR1HRH3IDO1
SCHEMBL8953984 0.68 MAOB (0.48) SIGMAR1TAAR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6743303-B2 CONTACTING METAL SURFACE WITH ADHESION PROMOTION FORMULATION COMPRISING SULFURIC ACID AND PHOSPHORIC ACID TO FORM A MICRO-ROUGHENED CONVERSION COATED METAL SURFACE, CONTACTING WITH AQUEOUS ORGANOSILICON FORMULATION SHIPLEY COMPANY, L.L.C. 2004-06-01 US disclosed
US-20020132056-A1 Contacting metal surface with adhesion promotion formulation comprising sulfuric acid and phosphoric acid to form a micro-roughened conversion coated metal surface, contacting with aqueous organosilicon formulation SHIPLEY COMPANY, L.L.C. (US) 2002-09-19 US disclosed