SCHEMBL9694565

SCHEMBL9694565

Cc1cc(C)c(O)c(Cn2c(=S)sc3ccccc32)c1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.39
CYP1A2 P05177 1/20 0.39
HPGD P15428 1/20 0.39
HSD17B10 Q99714 1/20 0.39
L3MBTL1 Q9Y468 5/20 0.36
TSHR P16473 3/20 0.35
TNF P01375 1/20 0.35
SMN1; SMN2 Q16637 4/20 0.34
RAB9A P51151 4/20 0.34
NPC1 O15118 3/20 0.34
MAPK1 P28482 1/20 0.34
TDP1 Q9NUW8 1/20 0.34
GAA P10253 1/20 0.34
DRD2 P14416 1/20 0.34
SLC6A4 P31645 1/20 0.34
SLC6A3 Q01959 1/20 0.34
EGFR P00533 1/20 0.34
ERBB2 P04626 1/20 0.34
KDM4E B2RXH2 1/20 0.34
PKM P14618 1/20 0.34

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
SCHEMBL9694177 0.85 HSPA5 (0.46) ALDH1A1CYP1A2HPGDHSD17B10L3MBTL1
SCHEMBL9694885 0.85 ALDH1A1 (0.39) ALDH1A1CYP1A2HPGDHSD17B10L3MBTL1
SCHEMBL9694960 0.83 L3MBTL1 (0.42) ALDH1A1CYP1A2HPGDHSD17B10L3MBTL1
SCHEMBL9694937 0.83 ALOX5 (0.37) ALDH1A1CYP1A2HPGDHSD17B10L3MBTL1
SCHEMBL9694765 0.78 ALOX5 (0.42) ALDH1A1CYP1A2HPGDHSD17B10L3MBTL1
SCHEMBL12376846 0.76 CYP1A2 (0.46) ALDH1A1CYP1A2HPGDHSD17B10L3MBTL1
SCHEMBL9694125 0.76 ALDH1A1 (0.37) ALDH1A1CYP1A2HPGDHSD17B10L3MBTL1
SCHEMBL9694913 0.76 L3MBTL1 (0.39) ALDH1A1CYP1A2HPGDHSD17B10L3MBTL1
SCHEMBL9694390 0.76 F2R (0.39) ALDH1A1CYP1A2HPGDHSD17B10L3MBTL1
SCHEMBL14572673 0.75 ALDH1A1 (0.38) ALDH1A1CYP1A2HPGDHSD17B10L3MBTL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5169950-A Reacting a 2-mercaptobenzothiazole, acarbonyl and a phenol; basic catalyst; polar solvent CIBA-GEIGY CORPORATION (US) 1992-12-08 US disclosed
US-5097039-A Coating, lubricants CIBA-GEIGY CORPORATION (US) 1992-03-17 US disclosed
US-5069805-A OIL ADDITIVES CIBA-GEIGY CORPORATION (US) 1991-12-03 US disclosed
EP-0259254-B1 PHENOLIC BENZOTHIAZOLE DERIVATIVES AND THEIR USE AS CORROSION INHIBITORS CIBA-GEIGY AG (CH) 1991-04-17 EP disclosed
US-4894091-A PROTECTIVE COATINGS, PHOTOSTABILIZERS, HEAT RESISTANCE CIBA-GEIGY CORPORATION (US) 1990-01-16 US disclosed
EP-0259254-A1 Phenolic benzothiazole derivatives and their use as corrosion inhibitors CIBA-GEIGY AG (CH) 1988-03-09 EP disclosed