SCHEMBL8869880

SCHEMBL8869880

CCOC(=O)CNC(=O)c1ccc(C(=O)NS(=O)(=O)c2ccc(C(=O)NCCOc3ccccc3)cc2)cn1

nearest known ligand 0.51

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 7/20 0.51
RAB9A P51151 6/20 0.51
SMN1; SMN2 Q16637 4/20 0.51
P4HTM Q9NXG6 3/20 0.48
POLB P06746 2/20 0.48
CASP3 P42574 1/20 0.48
SENP7 Q9BQF6 1/20 0.48
HPGD P15428 1/20 0.46
BCL2L1 Q07817 4/20 0.44
MCL1 Q07820 4/20 0.44
CNR1 P21554 1/20 0.42

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
SCHEMBL8868602 0.95 NPC1 (0.51) NPC1RAB9ASMN1; SMN2P4HTMPOLB
SCHEMBL8869213 0.92 RAB9A (0.53) NPC1RAB9ASMN1; SMN2P4HTMPOLB
SCHEMBL8869675 0.91 BCL2L1 (0.50) NPC1RAB9ASMN1; SMN2P4HTMPOLB
SCHEMBL8868530 0.90 P4HTM (0.49) NPC1RAB9ASMN1; SMN2P4HTMPOLB
SCHEMBL8867993 0.89 P4HTM (0.46) NPC1RAB9ASMN1; SMN2P4HTMPOLB
SCHEMBL9141114 0.89 NPC1 (0.54) NPC1RAB9ASMN1; SMN2P4HTMPOLB
SCHEMBL8870849 0.89 RAB9A (0.54) NPC1RAB9ASMN1; SMN2P4HTMPOLB
SCHEMBL8869726 0.89 P4HTM (0.54) NPC1RAB9ASMN1; SMN2P4HTMPOLB
SCHEMBL8868613 0.89 RAB9A (0.50) NPC1RAB9ASMN1; SMN2P4HTMPOLB
SCHEMBL8868669 0.89 P4HTM (0.49) NPC1RAB9ASMN1; SMN2P4HTM

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