SCHEMBL6681638

SCHEMBL6681638

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

nearest known ligand 0.52

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
EPHX2 P34913 9/20 0.52
EPHX1 P07099 2/20 0.52
MEN1 O00255 1/20 0.44
ALDH1A1 P00352 1/20 0.44
MAPT P10636 1/20 0.44
KMT2A Q03164 1/20 0.44
NPSR1 Q6W5P4 1/20 0.44
SIGMAR1 Q99720 3/20 0.42
GRIN2D O15399 1/20 0.41
GRIN3B O60391 1/20 0.41
GRIN1 Q05586 1/20 0.41
GRIN2A Q12879 1/20 0.41
GRIN2B Q13224 1/20 0.41
GRIN2C Q14957 1/20 0.41
GRIN3A Q8TCU5 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
SCHEMBL3079393 0.78 EPHX2 (0.58) EPHX2EPHX1SIGMAR1GRIN2DGRIN3B
SCHEMBL1238988 0.76 ALDH1A1 (0.35) EPHX2EPHX1MEN1ALDH1A1KMT2A
Hydrochloric Acid SCHEMBL6158167 0.76 EPHX2 (0.56) EPHX2EPHX1ALDH1A1SIGMAR1GRIN2D
SCHEMBL7153182 0.74 MEN1 (0.44) EPHX2EPHX1MEN1ALDH1A1KMT2A
SCHEMBL3069081 0.74 EPHX2 (0.54) EPHX2EPHX1ALDH1A1SIGMAR1GRIN2D
SCHEMBL1237952 0.74 EPHX2 (0.54) EPHX2EPHX1SIGMAR1GRIN2DGRIN3B
SCHEMBL14503267 0.73 EPHX2 (0.64) EPHX2EPHX1MEN1ALDH1A1MAPT
SCHEMBL8391320 0.70 EPHX2 (0.67) EPHX2EPHX1ALDH1A1SIGMAR1
SCHEMBL8392931 0.70 EPHX2 (0.67) EPHX2EPHX1ALDH1A1KMT2A
SCHEMBL3073973 0.69 EPHX2 (1.00) EPHX2EPHX1ALDH1A1

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 5 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-2004065305-A1 NON-TOXIC CORROSION-PROTECTION PIGMENTS BASED ON MANGANESE UNIVERSITY OF DAYTON (US) 2004-08-05 WO disclosed
WO-2003060191-A2 NON-TOXIC CORROSION-PROTECTION CONVERSION COATINGES ABSED ON COBALT UNIVERSITY OF DAYTON (US) 2003-07-24 WO disclosed
WO-2003060192-A1 NON-TOXIC CORROSION-PROTECTION RINSES AND SEALS BASED 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