SCHEMBL9692934

SCHEMBL9692934

Oc1c(C2CCCCC2)cc(Cn2c(=S)sc3ccccc32)cc1C1CCCCC1

nearest known ligand 0.46

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
DRD2 P14416 1/20 0.46
SLC6A4 P31645 1/20 0.46
SLC6A3 Q01959 1/20 0.46
ALDH1A1 P00352 2/20 0.37
CYP1A2 P05177 1/20 0.37
HPGD P15428 1/20 0.37
HSD17B10 Q99714 1/20 0.37
KDM4E B2RXH2 2/20 0.36
PKM P14618 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
LMNA P02545 2/20 0.36
MEN1 O00255 1/20 0.36
KMT2A Q03164 1/20 0.36
TSHR P16473 1/20 0.35
HTT P42858 1/20 0.35
NUDT1 P36639 1/20 0.34
BACE1 P56817 1/20 0.34
SMN1; SMN2 Q16637 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
SCHEMBL9694780 0.92 DRD2 (0.42) DRD2SLC6A4SLC6A3ALDH1A1CYP1A2
SCHEMBL9694146 0.90 DRD2 (0.40) DRD2SLC6A4SLC6A3ALDH1A1CYP1A2
SCHEMBL9694157 0.76 TSHR (0.54) ALDH1A1CYP1A2HPGDHSD17B10KDM4E
SCHEMBL9694360 0.73 F2R (0.43) ALDH1A1CYP1A2HPGDHSD17B10KDM4E
SCHEMBL9694402 0.73 L3MBTL1 (0.40) ALDH1A1CYP1A2HPGDHSD17B10KDM4E
SCHEMBL77906 0.72 NUDT1 (0.42) KDM4EMEN1KMT2ANUDT1BACE1
SCHEMBL11780045 0.72 L3MBTL1 (0.65) ALDH1A1CYP1A2HPGDHSD17B10KDM4E
SCHEMBL9692922 0.71 TP53 (0.39) ALDH1A1CYP1A2HPGDHSD17B10KDM4E
SCHEMBL9694913 0.70 L3MBTL1 (0.39) ALDH1A1CYP1A2HPGDHSD17B10KDM4E
SCHEMBL9628523 0.69 DRD2 (0.52) DRD2SLC6A4SLC6A3ALDH1A1CYP1A2

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