SCHEMBL7067747

SCHEMBL7067747

Cc1ccccc1C(=S)c1ccc(Nc2ccccc2NCCCCCCO)cc1Cl

nearest known ligand 0.50

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
MAPK14 Q16539 13/20 0.50
MAPK13 O15264 12/20 0.50
MAPK12 P53778 12/20 0.50
MAPK11 Q15759 12/20 0.50
ALDH1A1 P00352 2/20 0.39
KDM4E B2RXH2 1/20 0.36
GAA P10253 1/20 0.36
MAPT P10636 1/20 0.36
HPGD P15428 1/20 0.36
TSHR P16473 1/20 0.36
HSD17B10 Q99714 1/20 0.36
SYK P43405 1/20 0.36
MT-CO2 P00403 1/20 0.35
AVPR2 P30518 1/20 0.34
OXTR P30559 1/20 0.34
AVPR1A P37288 1/20 0.34
BCL6 P41182 1/20 0.34
KCNH3 Q9ULD8 1/20 0.34

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
SCHEMBL6817820 0.96 MAPK14 (0.52) MAPK14MAPK13MAPK12MAPK11ALDH1A1
SCHEMBL6816785 0.88 MAPK14 (0.68) MAPK14MAPK13MAPK12MAPK11ALDH1A1
SCHEMBL6820653 0.83 MAPK14 (0.71) MAPK14MAPK13MAPK12MAPK11SYK
SCHEMBL5174459 0.82 MAPK14 (0.71) MAPK14MAPK13MAPK12MAPK11KDM4E
SCHEMBL6817560 0.81 MAPK14 (0.58) MAPK14MAPK13MAPK12MAPK11ALDH1A1
SCHEMBL1908412 0.81 MAPK14 (0.62) MAPK14MAPK13MAPK12MAPK11KDM4E
SCHEMBL6820921 0.79 MAPK14 (0.61) MAPK14MAPK13MAPK12MAPK11ALDH1A1
SCHEMBL1897537 0.79 MAPK14 (0.60) MAPK14MAPK13MAPK12MAPK11ALDH1A1
SCHEMBL1898336 0.78 MAPK14 (0.56) MAPK14MAPK13MAPK12MAPK11KDM4E
SCHEMBL7075394 0.78 MAPK14 (0.59) MAPK14MAPK13MAPK12MAPK11KDM4E

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 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
EP-1210320-A1 AMINOBENZOPHENONES AS INHIBITORS OF IL-1BETA AND TNF-ALPHA LEO PHARMACEUTICAL PRODUCTS LTD. A/S (LOVENS KEMISKE FABRIK PRODUKTIONSAKTIESELSKAB) (DK) 2002-06-05 EP disclosed
WO-2001005746-A1 AMINOBENZOPHENONES AS INHIBITORS OF IL-1β AND TNF-$g(a) Leo Pharmaceutical Products Ltd. A/S (Løvens Kemiske Fabrik Produktionsaktieselskab) (DK) 2001-01-25 WO disclosed