SCHEMBL14536366

SCHEMBL14536366

CC(C)=CC(C(=O)OC1CCCC1)=C(C)C

nearest known ligand 0.37

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
EPHX1 P07099 2/20 0.37
CA12 O43570 2/20 0.35
CA1 P00915 2/20 0.35
CA2 P00918 2/20 0.35
CA9 Q16790 2/20 0.35
NAAA Q02083 2/20 0.35
HTT P42858 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
CYP2C19 P33261 1/20 0.32
CYP19A1 P11511 2/20 0.30
GPR35 Q9HC97 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
SCHEMBL12119036 0.98 EPHX1 (0.40) EPHX1CA12CA1CA2CA9
SCHEMBL10231066 0.82 MAPT (0.41) EPHX1HTTSMN1; SMN2CYP19A1
SCHEMBL4676851 0.75 EPHX1 (0.47) EPHX1CA12CA1CA2CA9
SCHEMBL10065747 0.75 ALDH1A1 (0.40)
SCHEMBL29117871 0.74 EPHX1 (0.42) EPHX1CA12CA1CA2CA9
SCHEMBL10605789 0.74 EPHX1 (0.42) EPHX1CA12CA1CA2CA9
SCHEMBL341198 0.74 EPHX1 (0.42) EPHX1CA12CA1CA2CA9
SCHEMBL3013625 0.73 EPHX1 (0.45) EPHX1CA12CA1CA2CA9
SCHEMBL4672536 0.73 EPHX1 (0.50) EPHX1CA12CA1CA2CA9
SCHEMBL20530248 0.73 EPHX1 (0.39) EPHX1CA12CA1CA2CA9

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-20070122741-A1 Resist protective coating material and patterning process SHIN-ETSU CHEMICAL CO., LTD. (JP) 2007-05-31 US disclosed