SCHEMBL6980077

SCHEMBL6980077

Cc1ccc(NC(=O)Oc2ccnc(N3CCOCC3)c2)cc1NC(=O)c1ccc(CNCCCN2CCOCC2)cc1

nearest known ligand 0.55

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
MAPK14 Q16539 20/20 0.55
SMO Q99835 1/20 0.45

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
SCHEMBL6979778 0.90 MAPK14 (0.56) MAPK14SMO
SCHEMBL6980707 0.90 MAPK14 (0.67) MAPK14
SCHEMBL6979212 0.84 MAPK14 (0.55) MAPK14SMO
SCHEMBL6974176 0.83 MAPK14 (0.54) MAPK14
SCHEMBL6970377 0.82 MAPK14 (0.53) MAPK14SMO
SCHEMBL6978667 0.82 MAPK14 (0.55) MAPK14SMO
SCHEMBL6966955 0.80 MAPK14 (0.67) MAPK14
SCHEMBL6968978 0.79 MAPK14 (0.54) MAPK14SMO
SCHEMBL6975392 0.78 MAPK14 (0.53) MAPK14SMO
SCHEMBL6967836 0.78 MAPK14 (0.70) MAPK14SMO

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
EP-1115707-B1 BENZAMIDE DERIVATIVES AND THER USE AS CYTOKINE INHIBITORS ASTRAZENECA AB (SE) 2003-11-12 EP claimed