SCHEMBL6014943

SCHEMBL6014943

Cc1ccc(Oc2ccnc(C(=O)NP)c2)cc1

nearest known ligand 0.53

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
KDR P35968 4/20 0.53
BRAF P15056 3/20 0.51
RAF1 P04049 2/20 0.51
EPHX2 P34913 1/20 0.48
MAPK14 Q16539 1/20 0.48
P2RX3 P56373 3/20 0.46
GRM5 P41594 2/20 0.46
MMP13 P45452 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
SCHEMBL167964 0.87 KDR (0.68) KDRBRAFRAF1EPHX2MAPK14
SCHEMBL18519134 0.85 KDR (0.48) KDRBRAFRAF1EPHX2MAPK14
SCHEMBL6014106 0.83 RAF1 (0.58) KDRBRAFRAF1EPHX2MAPK14
SCHEMBL6014711 0.82 KDR (0.49) KDRBRAFRAF1EPHX2MAPK14
SCHEMBL14208186 0.82 KDR (0.50) KDRBRAFRAF1EPHX2MAPK14
SCHEMBL6014835 0.82 MMP13 (0.64) KDRBRAFRAF1EPHX2P2RX3
SCHEMBL903580 0.82 P2RX3 (0.53) KDRBRAFRAF1EPHX2MAPK14
SCHEMBL15295583 0.81 RAF1 (0.55) KDRBRAFRAF1EPHX2MAPK14
SCHEMBL257959 0.81 RAF1 (0.50) KDRBRAFRAF1MAPK14P2RX3
SCHEMBL6014158 0.78 RAF1 (0.54) KDRBRAFRAF1EPHX2MAPK14

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
EP-2298311-B1 w-Carboxy aryl substituted diphenyl ureas as p38 kinase inhibitors BAYER HEALTHCARE LLC (US) 2012-05-09 EP disclosed
EP-1690853-B1 Use of omega-carboxyaryl substituted diphenyl ureas as raf kinase inhibitors BAYER HEALTHCARE LLC (US) 2010-03-10 EP disclosed