SCHEMBL29057152

SCHEMBL29057152

CCCCCCCCCc1ccc(OC(=O)Oc2ccc(C3CCCCC3)cc2)cc1

nearest known ligand 0.54

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
SPHK1 Q9NYA1 13/20 0.54
THRB P10828 3/20 0.52
THRA P10827 2/20 0.52
EPHX1 P07099 1/20 0.49
EPHX2 P34913 1/20 0.49
SPHK2 Q9NRA0 7/20 0.48

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
SCHEMBL10707886 0.95 SPHK1 (0.47) SPHK1THRBTHRA
SCHEMBL11291975 0.89 SPHK1 (0.51) SPHK1THRBTHRASPHK2
SCHEMBL11300371 0.89 SPHK1 (0.51) SPHK1THRBTHRASPHK2
SCHEMBL11291851 0.89 SPHK1 (0.51) SPHK1THRBTHRASPHK2
SCHEMBL11300206 0.89 SPHK1 (0.51) SPHK1THRBTHRASPHK2
SCHEMBL11293620 0.89 SPHK1 (0.51) SPHK1THRBTHRASPHK2
SCHEMBL11292835 0.88 MAPT (0.50) SPHK1THRBTHRASPHK2
Bicarbonate SCHEMBL11344777 0.85 SPHK1 (0.60) SPHK1EPHX1EPHX2SPHK2
SCHEMBL11278530 0.85 SPHK1 (0.71) SPHK1EPHX1EPHX2SPHK2
SCHEMBL28160529 0.85 SPHK1 (0.71) SPHK1EPHX1EPHX2SPHK2

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-111542565-B Plastic film with reduced UV activity 科思创德国股份有限公司 2023-08-22 CN disclosed