SCHEMBL29200801

SCHEMBL29200801

C1CCC(C2CCC(C3CCCCC3)(C3CCCCC3)CC2)CC1

nearest known ligand 0.44

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.44
HSD17B10 Q99714 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
SCHEMBL11572260 0.80 SCN1A (0.38)
SCHEMBL29142963 0.79 SCN1A (0.36)
SCHEMBL30492082 0.79 SCN1A (0.41) HSD17B10
SCHEMBL8529811 0.79 SCN1A (0.41) HSD17B10
SCHEMBL4654056 0.79 SCN1A (0.31)
SCHEMBL2993610 0.79 SCN1A (0.41) HSD17B10
SCHEMBL181178 0.79 SCN1A (0.41) HSD17B10
SCHEMBL4697737 0.79 SCN1A (0.41) HSD17B10
SCHEMBL4655278 0.79 SCN1A (0.41) HSD17B10
SCHEMBL1630078 0.79 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-117658814-A Novel compound for light-emitting element and organic light-emitting element comprising same 东进世美肯株式会社 2024-03-08 CN disclosed