SCHEMBL27869151

SCHEMBL27869151

C=COCC=C(C)C(=O)OC1CCCCC1

nearest known ligand 0.39

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
EPHX1 P07099 2/20 0.39
NAAA Q02083 2/20 0.36
HTT P42858 1/20 0.36
CYP2C19 P33261 1/20 0.34
CYP19A1 P11511 3/20 0.31
CA12 O43570 1/20 0.30
CA1 P00915 1/20 0.30
CA2 P00918 1/20 0.30
CA9 Q16790 1/20 0.30

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
SCHEMBL12803291 0.84 EPHX1 (0.40) EPHX1NAAAHTTCYP2C19
SCHEMBL4542072 0.81 EPHX1 (0.41) EPHX1NAAAHTTCYP2C19CYP19A1
SCHEMBL2688916 0.81 LMNA (0.39)
SCHEMBL2987394 0.78 EPHX1 (0.49) EPHX1NAAAHTTCYP2C19CYP19A1
SCHEMBL29276362 0.78 EPHX1 (0.49) EPHX1NAAAHTTCYP2C19CYP19A1
SCHEMBL29117589 0.78 EPHX1 (0.49) EPHX1NAAAHTTCYP2C19CYP19A1
SCHEMBL12803292 0.77 EPHX1 (0.38) EPHX1NAAAHTTCYP2C19CYP19A1
SCHEMBL632278 0.76 EPHX1 (0.46) EPHX1NAAAHTTCYP2C19CYP19A1
SCHEMBL29117702 0.76 NAAA (0.46) EPHX1NAAAHTTCYP2C19CYP19A1
SCHEMBL27085758 0.76 EPHX1 (0.42) EPHX1NAAAHTTCYP2C19CYP19A1

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-101059656-B Photo-sensitive resin composition containing inorganic particle, photo-sensitive film, and process of forming inorganic pattern JSR CORP 2012-05-16 CN disclosed