SCHEMBL11547696

SCHEMBL11547696

CCCCCCCCCCCCCCCCCCC=COOCc1ccccc1

nearest known ligand 0.46

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
EPHX2 P34913 4/20 0.45
FAAH O00519 2/20 0.45
CETP P11597 3/20 0.43
CNR1 P21554 1/20 0.43
CNR2 P34972 1/20 0.43
KCNH2 Q12809 3/20 0.41
PPARA Q07869 1/20 0.41
SOAT2 O75908 1/20 0.40
SOAT1 P35610 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
SCHEMBL8650647 0.84 EPHX2 (0.47) EPHX2FAAHCETPCNR1CNR2
SCHEMBL8650650 0.84 EPHX2 (0.47) EPHX2FAAHCETPCNR1CNR2
SCHEMBL22207390 0.84 EPHX2 (0.47) EPHX2FAAHCETPCNR1CNR2
SCHEMBL25365281 0.81 EPHX2 (0.48) EPHX2FAAHCETPCNR1CNR2
SCHEMBL1068374 0.77 IDO1 (0.41) EPHX2FAAHCETPCNR1CNR2
SCHEMBL1068376 0.77 IDO1 (0.41) EPHX2FAAHCETPCNR1CNR2
SCHEMBL23533338 0.76 EPHX2 (0.49) EPHX2FAAHCETPCNR1CNR2
SCHEMBL9197255 0.76 TDP1 (0.50) EPHX2FAAHCNR1CNR2PPARA
SCHEMBL23533392 0.76 EPHX2 (0.49) EPHX2FAAHCETPCNR1CNR2
SCHEMBL14496883 0.76 TDP1 (0.50) EPHX2FAAHCNR1CNR2PPARA

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
US-4140665-A NATURAL AND SYNTHETIC LATEXES BAYER AKTIENGESELLSCHAFT (DE) 1979-02-20 US disclosed
US-4131603-A Heat sensitizing mixture comprising an amide and a heat sensitizing agent which is a poly(alkylene oxide) containing urethane groups BAYER AKTIENGESELLSCHAFT (DE) 1978-12-26 US disclosed