SCHEMBL6014829

SCHEMBL6014829

Cc1ccc(Cc2ccnc(C(N)=O)c2)cc1

nearest known ligand 0.52

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
NR3C2 P08235 3/20 0.52
GRM2 Q14416 7/20 0.45
CSF1R P07333 1/20 0.44
CYP17A1 P05093 1/20 0.43
KLKB1 P03952 2/20 0.42
KLK1 P06870 2/20 0.42
NPC1 O15118 1/20 0.42
RAB9A P51151 1/20 0.42
SRD5A2 P31213 1/20 0.41
PARP10 Q53GL7 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.40

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
SCHEMBL17440067 0.84 PLA2G2A (0.51) NR3C2GRM2CSF1RCYP17A1
SCHEMBL29779639 0.82 KLKB1 (0.63) GRM2KLKB1KLK1
SCHEMBL6014195 0.80 PARP1 (0.56) NR3C2CSF1RKLKB1KLK1SMN1; SMN2
SCHEMBL17443023 0.79 GRM2 (0.41) NR3C2GRM2CSF1RCYP17A1
SCHEMBL2677778 0.78 SMYD3 (0.54) NPC1RAB9A
SCHEMBL13728182 0.77 GRM2 (0.43) NR3C2GRM2NPC1RAB9ASRD5A2
SCHEMBL27772527 0.77 MKNK1 (0.51) NR3C2GRM2
SCHEMBL20377228 0.76 CYP4F2 (0.45) NR3C2CSF1R
SCHEMBL2176535 0.76 LOXL2 (0.56)
SCHEMBL30193091 0.76 RECQL (0.50) NR3C2GRM2

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-2298311-B1 w-Carboxy aryl substituted diphenyl ureas as p38 kinase inhibitors BAYER HEALTHCARE LLC (US) 2012-05-09 EP disclosed