SCHEMBL7867903

SCHEMBL7867903

O=C(NCCO)Oc1ccc(C(=O)NS(=O)(=O)CCCCc2ccccc2)cn1

nearest known ligand 0.44

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
P4HTM Q9NXG6 1/20 0.44
GABRA5 P31644 3/20 0.44
NPC1 O15118 1/20 0.43
RAB9A P51151 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
OPRM1 P35372 6/20 0.41
OPRD1 P41143 6/20 0.41
OPRK1 P41145 4/20 0.41
EPHX2 P34913 2/20 0.39
HDAC1 Q13547 1/20 0.39

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
SCHEMBL7867806 0.97 P4HTM (0.45) P4HTMGABRA5NPC1RAB9ASMN1; SMN2
SCHEMBL7869446 0.90 GABRA5 (0.45) P4HTMGABRA5NPC1RAB9ASMN1; SMN2
SCHEMBL7871645 0.88 P4HTM (0.58) P4HTMGABRA5NPC1RAB9ASMN1; SMN2
SCHEMBL7871596 0.87 GABRA5 (0.45) P4HTMGABRA5NPC1RAB9ASMN1; SMN2
SCHEMBL8869377 0.86 P4HTM (0.56) P4HTMNPC1RAB9ASMN1; SMN2EPHX2
SCHEMBL9574661 0.86 GABRA5 (0.51) GABRA5
SCHEMBL7869443 0.85 P4HTM (0.43) P4HTMGABRA5NPC1RAB9ASMN1; SMN2
SCHEMBL7862856 0.84 HSP90AA1 (0.46) P4HTMGABRA5NPC1RAB9ASMN1; SMN2
SCHEMBL9018358 0.84 GABRA5 (0.49) P4HTMGABRA5NPC1RAB9ASMN1; SMN2
SCHEMBL7874552 0.83 P4HTM (0.46) P4HTMGABRA5NPC1RAB9ASMN1; SMN2

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