SCHEMBL6904625

SCHEMBL6904625

Cc1ccccc1C(=O)c1ccc(Nc2ccc(Br)cc2NC(=O)O)cc1Cl

nearest known ligand 0.75

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
MAPK14 Q16539 13/20 0.75
MAPK13 O15264 12/20 0.75
MAPK12 P53778 12/20 0.75
MAPK11 Q15759 12/20 0.75
MAPK1 P28482 1/20 0.45
MAPT P10636 1/20 0.45
TP53 P04637 1/20 0.43
MEN1 O00255 1/20 0.42
KMT2A Q03164 1/20 0.42
GRM4 Q14833 1/20 0.42
DHODH Q02127 1/20 0.42
AVPR2 P30518 1/20 0.41
OXTR P30559 1/20 0.41
AVPR1A P37288 1/20 0.41

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
SCHEMBL7646834 0.93 MAPK14 (0.80) MAPK14MAPK13MAPK12MAPK11MAPK1
SCHEMBL27484493 0.92 MAPK14 (0.63) MAPK14MAPK13MAPK12MAPK11MAPK1
SCHEMBL6094761 0.89 MAPK14 (0.66) MAPK14MAPK13MAPK12MAPK11MAPK1
SCHEMBL6094767 0.89 MAPK14 (0.66) MAPK14MAPK13MAPK12MAPK11MAPK1
SCHEMBL6905240 0.89 MAPK14 (0.68) MAPK14MAPK13MAPK12MAPK11MAPK1
SCHEMBL1906604 0.89 MAPK14 (0.81) MAPK14MAPK13MAPK12MAPK11MAPK1
SCHEMBL1906530 0.89 MAPK14 (0.81) MAPK14MAPK13MAPK12MAPK11MAPT
SCHEMBL6651799 0.89 MAPK14 (0.84) MAPK14MAPK13MAPK12MAPK11MAPT
SCHEMBL6903370 0.88 MAPK14 (0.59) MAPK14MAPK13MAPK12MAPK11MAPK1
SCHEMBL6906594 0.88 MAPK13 (0.59) MAPK14MAPK13MAPK12MAPK11TP53

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-1202959-B1 AMINOBENZOPHENONES AS INHIBITORS OF IL-1-BETA AND TNF-ALPHA LEO PHARMA AS (DK) 2004-09-29 EP claimed