SCHEMBL934606

SCHEMBL934606

CCCCC(=O)NCc1cccc(OC)c1

nearest known ligand 0.90

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
EPHX2 P34913 7/20 0.90
FAAH O00519 3/20 0.78
ALDH1A1 P00352 1/20 0.68
HTT P42858 1/20 0.68
SMN1; SMN2 Q16637 1/20 0.68
CNR1 P21554 1/20 0.67
POLB P06746 1/20 0.64

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
SCHEMBL30541869 0.95 EPHX2 (1.00) EPHX2FAAHCNR1
SCHEMBL28136625 0.95 EPHX2 (1.00) EPHX2FAAHCNR1
SCHEMBL28007018 0.95 EPHX2 (1.00) EPHX2FAAHCNR1
SCHEMBL30541868 0.95 EPHX2 (1.00) EPHX2FAAHCNR1
SCHEMBL19002581 0.92 EPHX2 (0.80) EPHX2FAAHALDH1A1HTTSMN1; SMN2
SCHEMBL31659445 0.88 EPHX2 (0.96) EPHX2FAAHCNR1
SCHEMBL29639613 0.88 EPHX2 (1.00) EPHX2FAAHCNR1
SCHEMBL22558561 0.88 EPHX2 (1.00) EPHX2FAAHCNR1
SCHEMBL22558582 0.88 EPHX2 (1.00) EPHX2FAAHCNR1
SCHEMBL31659466 0.88 EPHX2 (0.96) EPHX2FAAHCNR1

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-2454243-A2 TETRAZOLE DERIVATIVES Merck Serono SA (CH) 2012-05-23 EP disclosed
WO-2011006935-A2 TETRAZOLE DERIVATIVES MERCK SERONO S.A. (CH) 2011-01-20 WO disclosed