SCHEMBL5569097

SCHEMBL5569097

Cc1cc(NC(=O)C2(NC(=O)Oc3ccc(Cl)s3)CC3CCC2O3)ccc1C(=O)N1CCNC(=O)CC1

nearest known ligand 0.39

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
MAPK14 Q16539 11/20 0.39
F10 P00742 1/20 0.37
MAPK13 O15264 1/20 0.31
MAPK12 P53778 1/20 0.31
MAPK11 Q15759 1/20 0.31

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
SCHEMBL3426030 0.89 F10 (0.45) MAPK14F10MAPK13MAPK12MAPK11
SCHEMBL3428575 0.71 F10 (0.48) MAPK14F10MAPK13MAPK12MAPK11
SCHEMBL3428811 0.70 F10 (0.41) F10
SCHEMBL3424592 0.68 F10 (0.77) MAPK14F10MAPK13MAPK12MAPK11
SCHEMBL3428639 0.66 F10 (0.47) MAPK14F10
SCHEMBL3426427 0.66 MAPK14 (0.39) MAPK14F10MAPK13MAPK12MAPK11
SCHEMBL6454562 0.65 F10 (0.40) F10
SCHEMBL3428572 0.65 F10 (0.47) MAPK14F10
SCHEMBL3426176 0.64 CA12 (0.36) F10
SCHEMBL3427642 0.63 F10 (0.49) MAPK14F10

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1748996-A1 SUBSTITUTED THIOPHEN-CARBOXYLIC ACID AMIDES, THE PRODUCTION AND THE USE THEREOF IN THE FORM OF A DRUG Boehringer Ingelheim International GmbH (DE) 2007-02-07 EP disclosed
WO-2005111014-A1 SUBSTITUTED THIOPHEN-CARBOXYLIC ACID AMIDES, THE PRODUCTION AND THE USE THEREOF IN THE FORM OF A DRUG BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2005-11-24 WO disclosed