SCHEMBL28079135

SCHEMBL28079135

c1csc(SSSSc2nccs2)n1

nearest known ligand 0.80

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
FBP1 P09467 14/20 0.80
PDK1 Q15118 1/20 0.80
HTR7 P34969 1/20 0.45
FDPS P14324 1/20 0.45
ALDH1A1 P00352 1/20 0.42
TSHR P16473 1/20 0.42
NOS1 P29475 1/20 0.42
HSD17B10 Q99714 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.35
MGAM O43451 2/20 0.35
GAA P10253 2/20 0.35
SI P14410 2/20 0.35
MGAM2 Q2M2H8 2/20 0.35

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
SCHEMBL28382830 0.97 FBP1 (0.76) FBP1PDK1HTR7FDPSALDH1A1
SCHEMBL191350 0.89 FBP1 (1.00) FBP1PDK1HTR7FDPSALDH1A1
SCHEMBL8372218 0.86
SCHEMBL11445382 0.80
SCHEMBL8371244 0.80
SCHEMBL9731968 0.80
SCHEMBL11819066 0.78 FBP1 (0.70) FBP1PDK1HTR7FDPSALDH1A1
SCHEMBL11818034 0.78 FBP1 (0.70) FBP1PDK1HTR7FDPSALDH1A1
SCHEMBL11824120 0.78 FBP1 (0.77) FBP1PDK1HTR7FDPSALDH1A1
SCHEMBL11829207 0.78 FBP1 (0.81) FBP1PDK1HTR7FDPSALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-105462007-B Rubber composition for tire and tire 住友橡胶工业株式会社 2019-08-06 CN disclosed
CN-110023355-A Method for producing conjugated diene copolymer, conjugated diene copolymer produced thereby, and rubber composition containing same 株式会社LG化学 2019-07-16 CN disclosed
CN-105073808-B The manufacturing method of radial conjugated diene rubber 日本瑞翁株式会社 2018-06-29 CN disclosed
CN-104379658-B Rubber composition for tire tread 株式会社普利司通 2016-10-19 CN disclosed
CN-103958600-B Rubber composition, rubber elastomer, tire and block copolymer JSR株式会社 2016-08-24 CN disclosed