SCHEMBL6832695

SCHEMBL6832695

O=C(O)N(C(=O)NC12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2

nearest known ligand 0.52

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
EPHX2 P34913 9/20 0.52
EPHX1 P07099 2/20 0.52
KMT2A Q03164 2/20 0.45
MEN1 O00255 1/20 0.45
ALDH1A1 P00352 1/20 0.45
GAA P10253 1/20 0.45
HTT P42858 1/20 0.45
FAAH O00519 1/20 0.44
SMN1; SMN2 Q16637 1/20 0.41

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
SCHEMBL3081626 0.81 EPHX2 (0.47) EPHX2EPHX1KMT2AHTTSMN1; SMN2
SCHEMBL15975483 0.76 EPHX2 (0.53) EPHX2EPHX1KMT2AALDH1A1FAAH
SCHEMBL6687969 0.73 THRB (0.39) EPHX2EPHX1ALDH1A1HTT
SCHEMBL1694443 0.72 EPHX2 (0.70) EPHX2EPHX1KMT2AALDH1A1FAAH
SCHEMBL30500314 0.72 EPHX2 (0.70) EPHX2EPHX1KMT2AALDH1A1FAAH
SCHEMBL24692259 0.71 EPHX2 (0.52) EPHX2EPHX1KMT2AMEN1ALDH1A1
SCHEMBL21616078 0.71 EPHX2 (0.52) EPHX2EPHX1KMT2AMEN1ALDH1A1
SCHEMBL4431734 0.70 EPHX2 (0.67) EPHX2EPHX1KMT2AALDH1A1FAAH
SCHEMBL18884208 0.69 EPHX2 (0.73) EPHX2EPHX1KMT2AALDH1A1GAA
SCHEMBL3069160 0.69 EPHX2 (1.00) EPHX2EPHX1ALDH1A1HTT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1472319-A1 NON-TOXIC CORROSION PROTECTION PIGMENTS BASED ON COBALT UNIVERSITY OF DAYTON (US) 2004-11-03 EP disclosed
WO-2003060191-A2 NON-TOXIC CORROSION-PROTECTION CONVERSION COATINGES ABSED ON COBALT UNIVERSITY OF DAYTON (US) 2003-07-24 WO disclosed
WO-2003060019-A1 NON-TOXIC CORROSION PROTECTION PIGMENTS BASED ON COBALT UNIVERSITY OF DAYTON (US) 2003-07-24 WO disclosed