SCHEMBL9694402

SCHEMBL9694402

CC(C)c1cc(Cn2c(=S)sc3ccccc32)cc(C(C)C)c1O

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 2/20 0.40
LMNA P02545 2/20 0.40
MAPT P10636 1/20 0.40
KDM4E B2RXH2 1/20 0.40
PKM P14618 1/20 0.40
ALDH1A1 P00352 1/20 0.39
CYP1A2 P05177 1/20 0.39
HPGD P15428 1/20 0.39
HSD17B10 Q99714 1/20 0.39
THRB P10828 3/20 0.38
SMN1; SMN2 Q16637 2/20 0.38
TP53 P04637 1/20 0.38
TSHR P16473 1/20 0.38
HTT P42858 1/20 0.38
THRA P10827 2/20 0.37
MAPK1 P28482 2/20 0.37
POLB P06746 1/20 0.37
GAA P10253 1/20 0.37
GSR P00390 1/20 0.37
USP2 O75604 1/20 0.37

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
SCHEMBL9692922 0.89 TP53 (0.39) L3MBTL1LMNAKDM4EPKMALDH1A1
SCHEMBL9694125 0.83 ALDH1A1 (0.37) L3MBTL1LMNAKDM4EPKMALDH1A1
SCHEMBL9694960 0.83 L3MBTL1 (0.42) L3MBTL1LMNAKDM4EPKMALDH1A1
SCHEMBL9694539 0.80 L3MBTL1 (0.46) L3MBTL1LMNAMAPTKDM4EPKM
SCHEMBL9694157 0.80 TSHR (0.54) L3MBTL1LMNAMAPTKDM4EPKM
SCHEMBL9694360 0.80 F2R (0.43) L3MBTL1LMNAMAPTKDM4EPKM
SCHEMBL12376846 0.78 CYP1A2 (0.46) L3MBTL1LMNAMAPTPKMALDH1A1
SCHEMBL9694747 0.78 L3MBTL1 (0.43) L3MBTL1LMNAMAPTKDM4EPKM
SCHEMBL9694879 0.76 L3MBTL1 (0.50) L3MBTL1LMNAMAPTKDM4EPKM
SCHEMBL9814263 0.76 KDM4E (0.47) L3MBTL1LMNAMAPTKDM4EPKM

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