SCHEMBL7874244

SCHEMBL7874244

NCC(=O)NC(=O)Oc1ccc(C(=O)NS(=O)(=O)CCc2ccccc2)cn1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
P4HTM Q9NXG6 2/20 0.48
GABRA5 P31644 1/20 0.41
MMP1 P03956 1/20 0.40
MMP7 P09237 1/20 0.40
MMP8 P22894 1/20 0.40
MMP12 P39900 1/20 0.40
MMP13 P45452 1/20 0.40
OPRM1 P35372 9/20 0.40
OPRD1 P41143 9/20 0.40
OPRK1 P41145 7/20 0.40
NPC1 O15118 1/20 0.40
RAB9A P51151 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
GRIN2D O15399 1/20 0.38
GRIN3B O60391 1/20 0.38
SLC6A2 P23975 1/20 0.38
SLC6A3 Q01959 1/20 0.38
GRIN1 Q05586 1/20 0.38
KCNH2 Q12809 1/20 0.38
GRIN2A Q12879 1/20 0.38

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
SCHEMBL7874552 0.93 P4HTM (0.46) P4HTMGABRA5OPRM1OPRD1OPRK1
SCHEMBL7867686 0.92 P4HTM (0.58) P4HTMGABRA5MMP1MMP8MMP13
SCHEMBL7862825 0.89 P4HTM (0.43) P4HTMGABRA5MMP1MMP13OPRM1
SCHEMBL7871594 0.88 MMP8 (0.46) P4HTMMMP8MMP12MMP13OPRM1
SCHEMBL7862735 0.84 P4HTM (0.56) P4HTMLMNA
SCHEMBL7870554 0.82 NPC1 (0.49) P4HTMNPC1RAB9ASMN1; SMN2
SCHEMBL9018045 0.82 P4HTM (0.50) P4HTMGABRA5MMP1MMP7MMP8
SCHEMBL7871752 0.81 CXCR1 (0.39) P4HTMGABRA5RAB9ASMN1; SMN2EPHX2
SCHEMBL7874596 0.81 P4HTM (0.45) P4HTMGABRA5OPRM1OPRD1OPRK1
SCHEMBL7869436 0.81 NPC1 (0.44) P4HTMOPRM1OPRD1OPRK1NPC1

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