SCHEMBL9018360

SCHEMBL9018360

CC(C)OC(=O)Oc1ccc(C(=O)NS(=O)(=O)c2cccc(C(=O)NCCOc3ccccc3)c2)cn1

nearest known ligand 0.53

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 7/20 0.50
NPC1 O15118 7/20 0.44
SMN1; SMN2 Q16637 3/20 0.44
HPGD P15428 1/20 0.43
POLB P06746 2/20 0.42
BCL2L1 Q07817 2/20 0.42
MCL1 Q07820 2/20 0.42
CHRM2 P08172 1/20 0.42
CASP3 P42574 1/20 0.41
SENP7 Q9BQF6 1/20 0.41
RECQL P46063 1/20 0.41
KAT6A Q92794 3/20 0.41
P4HTM Q9NXG6 1/20 0.41

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
SCHEMBL9018136 0.93 RAB9A (0.53) RAB9ANPC1SMN1; SMN2HPGDPOLB
SCHEMBL9018154 0.92 RAB9A (0.49) RAB9ANPC1SMN1; SMN2HPGDPOLB
SCHEMBL9018375 0.92 MEN1 (0.41) RAB9ASMN1; SMN2HPGDCASP3P4HTM
SCHEMBL9018180 0.92 RAB9A (0.52) RAB9ANPC1SMN1; SMN2HPGDPOLB
SCHEMBL9018088 0.90 RAB9A (0.50) RAB9ANPC1SMN1; SMN2P4HTM
SCHEMBL9018346 0.89 RAB9A (0.39) RAB9ANPC1SMN1; SMN2BCL2L1MCL1
SCHEMBL9018010 0.89 RAB9A (0.44) RAB9ANPC1SMN1; SMN2HPGDPOLB
SCHEMBL9018341 0.89 RAB9A (0.50) RAB9ANPC1SMN1; SMN2HPGDPOLB
SCHEMBL9143465 0.88 RAB9A (0.53) RAB9ANPC1SMN1; SMN2HPGDPOLB
SCHEMBL9018465 0.88 ALDH1A1 (0.44) RAB9ANPC1SMN1; SMN2HPGDP4HTM

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-0590520-B1 Acylsulphonamido and sulphonamidopyridine-2-carboxylic acid esters, pyridine-n-oxides thereof, a process for their preparation and their use as medicaments HOECHST AG (DE) 1996-06-12 EP disclosed
EP-0590520-A1 Acylsulphonamido and sulphonamidopyridine-2-carboxylic acid esters, pyridine-n-oxides thereof, a process for their preparation and their use as medicaments HOECHST AKTIENGESELLSCHAFT (DE) 1994-04-06 EP disclosed