SCHEMBL9875656

SCHEMBL9875656

CCCCCCCCCCCCCCCc1ccc2ccccc(OC)c1-2

nearest known ligand 0.53

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 5/20 0.53
PTGS2 P35354 4/20 0.53
ELANE P08246 3/20 0.51
PPARA Q07869 1/20 0.50
CTSG P08311 1/20 0.44
THRA P10827 1/20 0.43
THRB P10828 1/20 0.43
LIPG Q9Y5X9 1/20 0.42
HTR2A P28223 1/20 0.42

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
SCHEMBL9875539 1.00 ALOX5 (0.53) ALOX5PTGS2ELANEPPARACTSG
SCHEMBL9876117 1.00 ALOX5 (0.53) ALOX5PTGS2ELANEPPARACTSG
SCHEMBL29197409 0.91 PTGS2 (0.60) ALOX5PTGS2ELANEPPARACTSG
SCHEMBL9876120 0.86 MEN1 (0.46) ALOX5PTGS2PPARATHRATHRB
SCHEMBL27592183 0.86 ALOX5 (0.54) ALOX5PTGS2ELANEPPARACTSG
SCHEMBL9876234 0.84 ALOX5 (0.40) ALOX5PTGS2ELANEPPARATHRA
SCHEMBL9876233 0.84 ALOX5 (0.40) ALOX5PTGS2ELANEPPARATHRA
SCHEMBL22412940 0.82 ALOX5 (0.47) ALOX5PTGS2ELANEPPARACTSG
SCHEMBL29005750 0.81 PPARA (0.50) ALOX5PTGS2PPARATHRATHRB
SCHEMBL9875998 0.81 ALOX5 (0.48) ALOX5PTGS2ELANEPPARAHTR2A

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
US-5037575-A Photostability MITSUBISHI CHEMICAL INDUSTRIES LTD. (JP) 1991-08-06 US disclosed