SCHEMBL7871663

SCHEMBL7871663

COCCNC(=O)Oc1ccc(C(=O)NS(=O)(=O)c2ccc(C(=O)NCc3ccccc3)cc2)cn1

nearest known ligand 0.49

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
EPHX2 P34913 4/20 0.49
SCN3A Q9NY46 1/20 0.48
L3MBTL1 Q9Y468 1/20 0.47
ALDH1A1 P00352 2/20 0.45
LMNA P02545 1/20 0.45
P4HTM Q9NXG6 2/20 0.45
CA2 P00918 1/20 0.45
OPRM1 P35372 1/20 0.44
OPRD1 P41143 1/20 0.44
OPRK1 P41145 1/20 0.44
HPGDS O60760 1/20 0.43
CXCR3 P49682 1/20 0.43
GABRA5 P31644 1/20 0.43
NAMPT P43490 1/20 0.42
CA12 O43570 1/20 0.42
CA9 Q16790 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
SCHEMBL7867889 0.91 HTT (0.51) EPHX2L3MBTL1ALDH1A1LMNAP4HTM
SCHEMBL7874583 0.91 NPC1 (0.45) EPHX2P4HTMOPRM1OPRD1OPRK1
SCHEMBL7867912 0.91 EGFR (0.47) EPHX2ALDH1A1P4HTMGABRA5
SCHEMBL7871609 0.91 P4HTM (0.55) P4HTMGABRA5NAMPT
SCHEMBL7867808 0.90 HSP90AA1 (0.44) EPHX2ALDH1A1P4HTMOPRK1GABRA5
SCHEMBL7870523 0.90 MEN1 (0.47) ALDH1A1LMNAP4HTMOPRM1OPRD1
SCHEMBL7871570 0.88 EGFR (0.45) EPHX2P4HTMOPRM1OPRD1OPRK1
SCHEMBL7862839 0.87 SMN1; SMN2 (0.48) ALDH1A1LMNAP4HTMNAMPT
SCHEMBL7869459 0.87 MCL1 (0.52) P4HTMOPRM1OPRD1OPRK1
SCHEMBL7870461 0.86 ALDH1A1 (0.49) L3MBTL1ALDH1A1LMNAP4HTMOPRM1

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