SCHEMBL31733892

SCHEMBL31733892

C=C(C)C(=O)NC(=O)CS

nearest known ligand 0.36

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
TGFBR1 P36897 1/20 0.36
ALDH1A1 P00352 2/20 0.33
TSHR P16473 1/20 0.33
HSD17B10 Q99714 1/20 0.33
TDP1 Q9NUW8 1/20 0.32
KDM4E B2RXH2 1/20 0.31

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
SCHEMBL194027 0.78 TGFBR1 (0.38) TGFBR1ALDH1A1HSD17B10TDP1KDM4E
SCHEMBL5681532 0.78 TGFBR1 (0.38) TGFBR1ALDH1A1TDP1KDM4E
SCHEMBL8984421 0.78 TGFBR1 (0.42) TGFBR1ALDH1A1TDP1KDM4E
SCHEMBL139723 0.76
SCHEMBL1015123 0.76 TDP1 (0.38) TGFBR1ALDH1A1TDP1KDM4E
SCHEMBL2923792 0.76 TGFBR1 (0.36) TGFBR1ALDH1A1TDP1KDM4E
SCHEMBL7171041 0.76 ALDH1A1 (0.45) TGFBR1ALDH1A1TSHRHSD17B10TDP1
SCHEMBL78126 0.76 ALDH1A1 (0.45) TGFBR1ALDH1A1TSHRHSD17B10TDP1
SCHEMBL1695583 0.74 TGFBR1 (0.35) TGFBR1ALDH1A1TDP1KDM4E
SCHEMBL4732318 0.74 TGFBR1 (0.39) TGFBR1ALDH1A1TDP1KDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-120988668-A Oil-soluble asphalt dispersant composition and performance test method thereof 西南石油大学 2025-11-21 CN disclosed