SCHEMBL7870554

SCHEMBL7870554

NCC(=O)NC(=O)Oc1ccc(C(=O)NS(=O)(=O)c2ccc(C(=O)NCCc3ccccc3)cc2)cn1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 5/20 0.49
RAB9A P51151 5/20 0.49
SMN1; SMN2 Q16637 4/20 0.49
MEN1 O00255 4/20 0.45
KMT2A Q03164 4/20 0.45
RXFP1 Q9HBX9 1/20 0.45
MAPT P10636 2/20 0.44
P4HTM Q9NXG6 2/20 0.44
HDAC2 Q92769 1/20 0.44
HDAC8 Q9BY41 1/20 0.44
HDAC6 Q9UBN7 1/20 0.44
MCHR1 Q99705 1/20 0.43
BCL2L1 Q07817 1/20 0.43
MCL1 Q07820 1/20 0.43
NFKB1 P19838 1/20 0.43
NFKB2 Q00653 1/20 0.43
RELA Q04206 1/20 0.43
CA12 O43570 2/20 0.43
CA1 P00915 2/20 0.43
CA2 P00918 2/20 0.43

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
SCHEMBL7867814 0.97 MEN1 (0.48) NPC1RAB9ASMN1; SMN2MEN1KMT2A
SCHEMBL7869436 0.95 NPC1 (0.44) NPC1RAB9ASMN1; SMN2P4HTMBCL2L1
SCHEMBL7871605 0.94 HSP90AA1 (0.44) NPC1RAB9ASMN1; SMN2MEN1KMT2A
SCHEMBL7862716 0.92 CA2 (0.49) NPC1RAB9ASMN1; SMN2MEN1KMT2A
SCHEMBL7869439 0.92 RAB9A (0.42) NPC1RAB9ASMN1; SMN2MEN1KMT2A
SCHEMBL7874606 0.91 MAPT (0.48) NPC1RAB9ASMN1; SMN2MEN1KMT2A
SCHEMBL7862712 0.91 EGFR (0.51) NPC1RAB9ASMN1; SMN2MEN1KMT2A
SCHEMBL7862843 0.91 EGFR (0.51) NPC1RAB9ASMN1; SMN2MEN1KMT2A
SCHEMBL7870448 0.91 MAPT (0.48) NPC1RAB9ASMN1; SMN2MEN1KMT2A
SCHEMBL7867675 0.90 NPC1 (0.49) NPC1RAB9ASMN1; SMN2MEN1KMT2A

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-0562512-B1 Sulfonamidocarbonylpyridine-2-carboxamides and their use as medicines HOECHST AG (DE) 2001-02-21 EP disclosed
EP-0562512-A1 Sulfonamido- and sulfonamidocarbonyl-pyridine-2-carboxamides and their pyridine-N-oxides, process for their preparation and their use as medicines HOECHST AKTIENGESELLSCHAFT (DE) 1993-09-29 EP disclosed