SCHEMBL6817261

SCHEMBL6817261

Cc1cc(Cl)ccc1C(=O)c1ccc(Nc2ccc(Br)cc2NC(=O)CCC(=O)O)cc1Cl

nearest known ligand 0.54

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
MAPK1 P28482 2/20 0.54
MAPK13 O15264 9/20 0.53
MAPK12 P53778 9/20 0.53
MAPK11 Q15759 9/20 0.53
MAPK14 Q16539 9/20 0.53
SMN1; SMN2 Q16637 2/20 0.47
LMNA P02545 1/20 0.47
POLB P06746 1/20 0.47
KDM4E B2RXH2 1/20 0.40
TDP1 Q9NUW8 1/20 0.40
NPC1 O15118 1/20 0.40
RAB9A P51151 1/20 0.40
EGFR P00533 1/20 0.40
ERBB3 P21860 1/20 0.40
CYP2C9 P11712 1/20 0.40
CYP2C19 P33261 1/20 0.40
KMT2A Q03164 1/20 0.39
TSHR P16473 1/20 0.38

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
SCHEMBL6817260 1.00 MAPK1 (0.54) MAPK1MAPK13MAPK12MAPK11MAPK14
SCHEMBL6813206 0.91 MAPK1 (0.55) MAPK1MAPK13MAPK12MAPK11MAPK14
SCHEMBL6813196 0.91 MAPK1 (0.55) MAPK1MAPK13MAPK12MAPK11MAPK14
SCHEMBL6820873 0.91 MAPK1 (0.46) MAPK1MAPK13MAPK12MAPK11MAPK14
SCHEMBL6818058 0.91 MAPK13 (0.56) MAPK1MAPK13MAPK12MAPK11MAPK14
SCHEMBL6818054 0.91 MAPK13 (0.56) MAPK1MAPK13MAPK12MAPK11MAPK14
SCHEMBL6094761 0.91 MAPK14 (0.66) MAPK1MAPK13MAPK12MAPK11MAPK14
SCHEMBL6094767 0.91 MAPK14 (0.66) MAPK1MAPK13MAPK12MAPK11MAPK14
SCHEMBL6816809 0.88 MAPK1 (0.53) MAPK1MAPK13MAPK12MAPK11MAPK14
SCHEMBL6817365 0.88 MAPK1 (0.49) MAPK1MAPK13MAPK12MAPK11MAPK14

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1210320-B1 AMINOBENZOPHENONES AS INHIBITORS OF IL-1BETA AND TNF-ALPHA LEO PHARMA AS (DK) 2004-09-29 EP claimed
US-6566554-B1 Including amino benzothiophenones; useful for treatment of inflammatory diseases in which the production of cytokines is involved in the pathogenesis LEO PHARMACEUTICAL PRODUCTS LTD. A/S (LOVENS KEMISKE FABRIK PRODUKTIONSAKTIESELSKAB) (DK) 2003-05-20 US claimed
EP-1210320-B1 AMINOBENZOPHENONES AS INHIBITORS OF IL-1BETA AND TNF-ALPHA LEO PHARMA AS (DK) 2004-09-29 EP disclosed
US-6566554-B1 Including amino benzothiophenones; useful for treatment of inflammatory diseases in which the production of cytokines is involved in the pathogenesis LEO PHARMACEUTICAL PRODUCTS LTD. A/S (LOVENS KEMISKE FABRIK PRODUKTIONSAKTIESELSKAB) (DK) 2003-05-20 US disclosed