SCHEMBL7044567

SCHEMBL7044567

CCCCCCN(C)C(=O)c1nc(-c2ccccc2)c(-c2ccccc2)[nH]1

nearest known ligand 0.56

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
CSNK2A2 P19784 1/20 0.47
KDR P35968 1/20 0.47
CSNK2B P67870 1/20 0.47
CSNK2A1 P68400 1/20 0.47

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
SCHEMBL7048218 0.89
SCHEMBL7046455 0.88 KDM4E (0.46)
SCHEMBL7044710 0.79 KDM4E (0.43)
SCHEMBL7046399 0.78 CNR1 (0.51)
SCHEMBL7046656 0.76 CNR1 (0.52)
SCHEMBL7047758 0.76 KDM4E (0.51)
SCHEMBL9375520 0.72
SCHEMBL5178440 0.72 HDAC6 (0.57)
SCHEMBL7517981 0.72 HDAC6 (0.57)
SCHEMBL9475252 0.71 NOX1 (0.64)

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
WO-2003007887-A2 SUBSTITUTED IMIDAZOLES AS CANNABINOID RECEPTOR MODULATORS MERCK & CO., INC. (US) 2003-01-30 WO claimed
WO-2003007887-A2 SUBSTITUTED IMIDAZOLES AS CANNABINOID RECEPTOR MODULATORS MERCK & CO., INC. (US) 2003-01-30 WO disclosed