SCHEMBL7871752

SCHEMBL7871752

NCC(=O)NC(=O)Oc1ccc(C(=O)NS(=O)(=O)CCOc2ccc(F)cc2)cn1

nearest known ligand 0.39

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
CXCR1 P25024 7/20 0.39
CXCR2 P25025 7/20 0.39
ALDH1A1 P00352 2/20 0.36
RAB9A P51151 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
P4HTM Q9NXG6 1/20 0.35
GABRA5 P31644 1/20 0.35
MAPT P10636 1/20 0.34
MAPK1 P28482 1/20 0.34
CYP2C9 P11712 1/20 0.34
CYP2C19 P33261 1/20 0.34
EPHX2 P34913 1/20 0.34
CYP2J2 P51589 1/20 0.34

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
SCHEMBL7862825 0.90 P4HTM (0.43) CXCR1CXCR2P4HTMGABRA5EPHX2
SCHEMBL7874627 0.85 GABRA5 (0.43) CXCR1CXCR2ALDH1A1RAB9ASMN1; SMN2
SCHEMBL9018098 0.84 CXCR1 (0.44) CXCR1CXCR2ALDH1A1RAB9ASMN1; SMN2
SCHEMBL7862789 0.84 GABRA5 (0.45) CXCR1CXCR2ALDH1A1RAB9ASMN1; SMN2
SCHEMBL7871594 0.82 MMP8 (0.46) ALDH1A1RAB9AP4HTMMAPT
SCHEMBL9018431 0.82 CXCR2 (0.47) CXCR1CXCR2ALDH1A1RAB9AGABRA5
SCHEMBL7874244 0.81 P4HTM (0.48) CXCR2RAB9ASMN1; SMN2P4HTMGABRA5
SCHEMBL9018316 0.81 CXCR1 (0.45) CXCR1CXCR2ALDH1A1RAB9ASMN1; SMN2
SCHEMBL7867686 0.79 P4HTM (0.58) CXCR2RAB9ASMN1; SMN2P4HTMGABRA5
SCHEMBL7874552 0.79 P4HTM (0.46) RAB9ASMN1; SMN2P4HTMGABRA5EPHX2

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