SCHEMBL6904778

SCHEMBL6904778

Cc1ccccc1C(=O)c1ccc(Nc2ccccc2N(C(=O)O)C2CCCCC2)cc1Cl

nearest known ligand 0.64

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
MAPK14 Q16539 15/20 0.64
MAPK13 O15264 14/20 0.64
MAPK12 P53778 14/20 0.64
MAPK11 Q15759 14/20 0.64
LMNA P02545 1/20 0.42
POLB P06746 1/20 0.40
ATM Q13315 1/20 0.40
L3MBTL1 Q9Y468 1/20 0.40
NPC1 O15118 1/20 0.39
AVPR2 P30518 1/20 0.39
OXTR P30559 1/20 0.39
AVPR1A P37288 1/20 0.39

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
SCHEMBL6905617 0.99 MAPK14 (0.65) MAPK14MAPK13MAPK12MAPK11LMNA
SCHEMBL6905604 0.81 MAPK14 (0.71) MAPK14MAPK13MAPK12MAPK11LMNA
SCHEMBL6653998 0.80 MAPK14 (0.69) MAPK14MAPK13MAPK12MAPK11AVPR2
SCHEMBL1904637 0.79 MAPK14 (1.00) MAPK14MAPK13MAPK12MAPK11AVPR2
SCHEMBL6903356 0.79 MAPK13 (0.51) MAPK14MAPK13MAPK12MAPK11POLB
SCHEMBL6904590 0.79 MAPK13 (0.51) MAPK14MAPK13MAPK12MAPK11LMNA
SCHEMBL6905033 0.79 MAPK13 (0.51) MAPK14MAPK13MAPK12MAPK11LMNA
SCHEMBL1905352 0.79 MAPK14 (0.83) MAPK14MAPK13MAPK12MAPK11LMNA
SCHEMBL27497515 0.79 MAPK14 (0.71) MAPK14MAPK13MAPK12MAPK11LMNA
SCHEMBL6824822 0.78 MAPK13 (0.67) MAPK14MAPK13MAPK12MAPK11NPC1

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