SCHEMBL8868802

SCHEMBL8868802

CC(=O)NCCc1ccc(S(=O)(=O)NC(=O)c2ccc(C(=O)NCC(=O)OCc3ccccc3)nc2)cc1

nearest known ligand 0.48

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
P4HTM Q9NXG6 4/20 0.48
BCL2L1 Q07817 5/20 0.43
MCL1 Q07820 5/20 0.43
RAB9A P51151 2/20 0.42
NPC1 O15118 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
HIF1A Q16665 1/20 0.42
PPARA Q07869 1/20 0.42
POLB P06746 1/20 0.42
PKM P14618 1/20 0.42
CA2 P00918 1/20 0.42
MAPT P10636 2/20 0.42
MEN1 O00255 1/20 0.42
KMT2A Q03164 1/20 0.42
LMNA P02545 1/20 0.41
PTPRC P08575 1/20 0.41
PTPN1 P18031 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
SCHEMBL8867950 0.92 P4HTM (0.48) P4HTMBCL2L1MCL1RAB9ANPC1
SCHEMBL8869506 0.92 P4HTM (0.50) P4HTMBCL2L1MCL1RAB9ANPC1
SCHEMBL8869285 0.91 P4HTM (0.47) P4HTMBCL2L1MCL1RAB9ANPC1
SCHEMBL8868297 0.91 P4HTM (0.47) P4HTMBCL2L1MCL1RAB9ANPC1
SCHEMBL8868801 0.90 CA2 (0.46) P4HTMBCL2L1MCL1RAB9ANPC1
SCHEMBL8869589 0.90 MAPT (0.54) P4HTMBCL2L1MCL1RAB9ANPC1
SCHEMBL8867921 0.90 MAPT (0.54) P4HTMBCL2L1MCL1RAB9ANPC1
SCHEMBL9137990 0.90 P4HTM (0.51) P4HTMBCL2L1MCL1RAB9ANPC1
SCHEMBL8869813 0.90 P4HTM (0.52) P4HTMBCL2L1MCL1RAB9ANPC1
SCHEMBL8868573 0.89 BCL2L1 (0.51) P4HTMBCL2L1MCL1RAB9ANPC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5607954-A Sulfonamido- and sulfonamidocarbonylpyridine-2-carboxamides and their pyridine-n-oxides, process for their preparation and their use as pharmaceuticals HOECHST AKTIENGESELLSCHAFT (DE) 1997-03-04 US disclosed