SCHEMBL7805484

SCHEMBL7805484

Cc1ccc(Oc2nccc(-c3[nH]c(C4CCNCC4)nc3-c3ccc(F)cc3)n2)cc1

nearest known ligand 0.63

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
MAPK14 Q16539 20/20 0.63
BRD4 O60885 4/20 0.63
BRDT Q58F21 3/20 0.63
MAPK13 O15264 1/20 0.55
RAF1 P04049 1/20 0.55
MAPK9 P45984 1/20 0.55
MAPK12 P53778 1/20 0.55
MAPK11 Q15759 1/20 0.55

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
SCHEMBL4584672 0.95 MAPK14 (0.60) MAPK14BRD4BRDTMAPK13RAF1
SCHEMBL4585317 0.93 MAPK14 (0.63) MAPK14BRD4BRDTMAPK13RAF1
SCHEMBL4583854 0.91 MAPK14 (0.63) MAPK14BRD4BRDTMAPK13RAF1
SCHEMBL4584142 0.91 MAPK14 (0.63) MAPK14BRD4BRDTMAPK13RAF1
SCHEMBL4585291 0.91 MAPK14 (0.63) MAPK14BRD4BRDTMAPK13RAF1
SCHEMBL4586526 0.91 MAPK14 (0.61) MAPK14BRD4BRDTMAPK13RAF1
SCHEMBL7811844 0.90 MAPK14 (0.64) MAPK14BRD4BRDTMAPK13RAF1
SCHEMBL4584970 0.90 MAPK14 (0.64) MAPK14BRD4BRDTMAPK13RAF1
SCHEMBL4585692 0.89 MAPK14 (0.64) MAPK14BRD4BRDTMAPK13RAF1
SCHEMBL4584883 0.89 MAPK14 (0.65) MAPK14BRD4BRDTMAPK13RAF1

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-0996446-A4 NOVEL SUBSTITUTED IMIDAZOLE COMPOUNDS SMITHKLINE BEECHAM CORP (US) 2001-08-29 EP claimed
EP-0996446-A1 NOVEL SUBSTITUTED IMIDAZOLE COMPOUNDS SMITHKLINE BEECHAM CORPORATION (US) 2000-05-03 EP claimed
WO-1999001131-A1 NOVEL SUBSTITUTED IMIDAZOLE COMPOUNDS SMITHKLINE BEECHAM CORPORATION (US) 1999-01-14 WO claimed