SCHEMBL7344634

SCHEMBL7344634

CCCCCc1cc([C]=O)ccc1OC

nearest known ligand 0.56

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
HTR2A P28223 1/20 0.46
ALOX5 P09917 7/20 0.45
PTGS2 P35354 4/20 0.45
PPARA Q07869 2/20 0.43
PPARG P37231 1/20 0.40
MEN1 O00255 1/20 0.40
ALDH1A1 P00352 1/20 0.40
KMT2A Q03164 1/20 0.40
SPHK2 Q9NRA0 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
SCHEMBL10723938 0.86 MEN1 (0.48) HTR2AALOX5PTGS2PPARAPPARG
SCHEMBL15174546 0.83 TSHR (0.49) HTR2AALOX5PTGS2PPARASPHK2
SCHEMBL9298934 0.78 LIPG (0.41) ALOX5PPARAPPARGMEN1ALDH1A1
SCHEMBL7271422 0.77 THRA (0.51) ALDH1A1
SCHEMBL8907833 0.77 THRA (0.51) ALDH1A1
SCHEMBL9070266 0.77 PPARG (0.55) HTR2AALOX5PTGS2PPARAPPARG
SCHEMBL9889155 0.77 ADRA1A (0.64) HTR2AALOX5PTGS2
SCHEMBL5133668 0.76 ADRA1A (0.62) HTR2AALOX5PTGS2
SCHEMBL14122353 0.76 PPARG (0.57) HTR2AALOX5PTGS2PPARAPPARG
SCHEMBL10601156 0.76 ADRA1A (0.62) HTR2AALOX5PTGS2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0832886-B1 Flavon derivatives, process for their preparation, and pharmaceutical compositions containing them SERVIER LAB (FR) 2002-11-13 EP disclosed
EP-0832886-A1 Flavon derivatives, process for their preparation, and pharmaceutical compositions containing them ADIR ET COMPAGNIE (FR) 1998-04-01 EP disclosed