SCHEMBL31329709

SCHEMBL31329709

C1CCCC(C2(C3CCCC4CCCCC43)CCCCCC2)CC1

nearest known ligand 0.40

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
HSD17B10 Q99714 1/20 0.40

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
SCHEMBL17674850 1.00 HSD17B10 (0.40) HSD17B10
SCHEMBL381075 0.98 HSD17B10 (0.41) HSD17B10
SCHEMBL29565685 0.88 HSD17B10 (0.33) HSD17B10
SCHEMBL9820680 0.75 ESR1 (0.33)
SCHEMBL4748922 0.75 SCN1A (0.39) HSD17B10
SCHEMBL4012058 0.75 SCN1A (0.39) HSD17B10
SCHEMBL6756605 0.73 CDK5 (0.35) HSD17B10
SCHEMBL9820899 0.73 ESR1 (0.34)
SCHEMBL2993610 0.72 SCN1A (0.41) HSD17B10
SCHEMBL4697737 0.72 SCN1A (0.41) HSD17B10

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-115103841-B Substituted quinolinone piperazine compounds useful as T cell activators 百时美施贵宝公司 2024-12-27 CN disclosed