SCHEMBL4197299

SCHEMBL4197299

CCCCNS(=O)(=O)c1cccc(NC2CCN(S(=O)(=O)c3ccc(CNC(=O)c4ccc(Cl)cc4)s3)CC2)c1.CCc1cccc(NC2CCN(S(=O)(=O)c3ccc(CNC(=O)c4ccc(Cl)cc4)s3)CC2)c1

nearest known ligand 0.47

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
MAPK9 P45984 1/20 0.47
MAPK10 P53779 1/20 0.47
MEN1 O00255 2/20 0.45
KMT2A Q03164 2/20 0.45
MAPT P10636 3/20 0.43
ALDH1A1 P00352 3/20 0.39
TGM2 P21980 3/20 0.38
HSD11B1 P28845 3/20 0.37
LMNA P02545 2/20 0.37
MAPK1 P28482 1/20 0.37
L3MBTL1 Q9Y468 2/20 0.37
EPHX2 P34913 1/20 0.36
BCL2 P10415 1/20 0.36
BCL2L1 Q07817 1/20 0.36

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
SCHEMBL2425330 0.96 MAPK9 (0.51) MAPK9MAPK10MEN1KMT2AALDH1A1
SCHEMBL2420821 0.90 MAPK9 (0.56) MAPK9MAPK10MEN1KMT2AMAPT
SCHEMBL7439831 0.88 MEN1 (0.43) MAPK9MAPK10MEN1KMT2AMAPT
SCHEMBL4968679 0.88 MAPK9 (0.44) MAPK9MAPK10MEN1KMT2AMAPT
SCHEMBL1518735 0.86 MAPK9 (0.54) MAPK9MAPK10MEN1KMT2AMAPT
SCHEMBL2423593 0.85 KMT2A (0.48) MEN1KMT2AMAPTALDH1A1LMNA
SCHEMBL2424569 0.84 MAPK9 (0.56) MAPK9MAPK10MEN1KMT2AMAPT
SCHEMBL2418429 0.83 MEN1 (0.46) MAPK9MAPK10MEN1KMT2AMAPT
SCHEMBL5565272 0.83 MAPK9 (0.54) MAPK9MAPK10MEN1KMT2AMAPT
SCHEMBL1518747 0.83 MAPK9 (0.56) MAPK9MAPK10MEN1KMT2AMAPT

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-2026802-A2 JNK INHIBITORS FOR TREATMENT OF SKIN DISEASES Laboratoires Serono SA (CH) 2009-02-25 EP disclosed
WO-2007141224-A2 JNK INHIBITORS FOR TREATMENT OF SKIN DISEASES LABORATOIRES SERONO SA (CH) 2007-12-13 WO disclosed