SCHEMBL4189441

SCHEMBL4189441

O=C(NCc1ccc(S(=O)(=O)N2CCC(Nc3ccc(C(F)(F)F)cc3)CC2)s1)c1ccc(Cl)cc1.O=C(NCc1ccc(S(=O)(=O)N2CCC(Nc3ccc(Cl)cc3)CC2)s1)c1ccc(Cl)cc1

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPK9 P45984 1/20 0.57
MAPK10 P53779 1/20 0.57
MEN1 O00255 1/20 0.50
KMT2A Q03164 1/20 0.50
RHOC P08134 1/20 0.47
RHOA P61586 1/20 0.47
TP53 P04637 1/20 0.43
MAPT P10636 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
TRPV4 Q9HBA0 4/20 0.43
TGM2 P21980 1/20 0.42
EPHX2 P34913 3/20 0.42
NR1H4 Q96RI1 1/20 0.42
BCL2 P10415 1/20 0.41
BCL2L1 Q07817 1/20 0.41
ALDH1A1 P00352 3/20 0.41
USP5 P45974 1/20 0.41
LMNA P02545 1/20 0.41
FPR2 P25090 1/20 0.40
PROKR1 Q8TCW9 1/20 0.40

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
SCHEMBL2421312 1.00 MAPK9 (0.57) MAPK9MAPK10MEN1KMT2ARHOC
SCHEMBL1518918 0.94 MAPK9 (0.62) MAPK9MAPK10MEN1KMT2ATP53
SCHEMBL2424312 0.91 MAPK9 (0.55) MAPK9MAPK10MEN1KMT2ARHOC
SCHEMBL2422247 0.91 MAPK9 (0.54) MAPK9MAPK10MEN1KMT2ARHOC
SCHEMBL2420588 0.90 MAPK9 (0.59) MAPK9MAPK10MEN1KMT2ATP53
SCHEMBL2426728 0.90 MAPK9 (0.58) MAPK9MAPK10MEN1KMT2ATP53
SCHEMBL1518791 0.89 MAPK9 (0.64) MAPK9MAPK10MEN1KMT2ATP53
SCHEMBL6431692 0.89 MEN1 (0.62) MAPK9MAPK10MEN1KMT2ATP53
SCHEMBL3480493 0.89 MAPK9 (0.56) MAPK9MAPK10MEN1KMT2ATRPV4
SCHEMBL3480150 0.89 MAPK9 (0.56) MAPK9MAPK10MEN1KMT2ATGM2

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