SCHEMBL7870592

SCHEMBL7870592

O=C(NCCO)Oc1ccc(C(=O)NS(=O)(=O)c2ccc(CCNC(=O)c3ccc(F)cc3)cc2)cn1

nearest known ligand 0.52

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
MAPT P10636 1/20 0.50
BCL2L1 Q07817 1/20 0.46
MCL1 Q07820 1/20 0.46
CA12 O43570 2/20 0.45
CA1 P00915 2/20 0.45
CA2 P00918 2/20 0.45
CA9 Q16790 2/20 0.45
GABRA5 P31644 2/20 0.45
NPC1 O15118 3/20 0.44
RAB9A P51151 3/20 0.44
SMN1; SMN2 Q16637 1/20 0.44
MEN1 O00255 2/20 0.44
KMT2A Q03164 2/20 0.44
HTT P42858 1/20 0.44
PTGS2 P35354 3/20 0.43
EPHX2 P34913 1/20 0.43
PTGS1 P23219 1/20 0.43
LMNA P02545 1/20 0.42
TP53 P04637 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
SCHEMBL7869433 1.00 MAPT (0.50) MAPTBCL2L1MCL1CA12CA1
SCHEMBL7867790 0.92 MEN1 (0.48) MAPTBCL2L1MCL1CA12CA1
SCHEMBL7874555 0.91 MAPT (0.51) MAPTBCL2L1MCL1CA12CA1
SCHEMBL7862777 0.91 EGFR (0.53) MAPTBCL2L1MCL1CA12CA1
SCHEMBL7874505 0.91 EGFR (0.53) MAPTBCL2L1MCL1CA12CA1
SCHEMBL7871640 0.91 RAB9A (0.52) MAPTNPC1RAB9ASMN1; SMN2MEN1
SCHEMBL7870522 0.91 NPC1 (0.44) MAPTGABRA5NPC1RAB9ASMN1; SMN2
SCHEMBL7871573 0.91 NPC1 (0.45) MAPTBCL2L1MCL1CA1CA2
SCHEMBL7869464 0.89 KMT2A (0.56) MAPTCA12CA1CA2CA9
SCHEMBL7870590 0.89 MAPT (0.49) MAPTBCL2L1MCL1CA12CA1

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