SCHEMBL7862784

SCHEMBL7862784

O=C(NCCO)Oc1ccc(C(=O)NS(=O)(=O)c2ccc(Cl)c(C(=O)NCCOc3ccccc3)c2)cn1

nearest known ligand 0.46

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
HPGD P15428 2/20 0.46
ALDH1A1 P00352 1/20 0.46
NPC1 O15118 5/20 0.46
RAB9A P51151 5/20 0.46
SMN1; SMN2 Q16637 3/20 0.45
CA1 P00915 1/20 0.45
CA2 P00918 1/20 0.45
CA9 Q16790 1/20 0.45
CYP3A4 P08684 1/20 0.43
CYP2C9 P11712 1/20 0.43
CYP2C19 P33261 1/20 0.43
CCR2 P41597 1/20 0.43
CCR4 P51679 1/20 0.43
BCL2L1 Q07817 6/20 0.41
MCL1 Q07820 6/20 0.41
LMNA P02545 2/20 0.41
EGFR P00533 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
SCHEMBL7867706 0.94 HPGD (0.48) HPGDALDH1A1NPC1RAB9ASMN1; SMN2
SCHEMBL7874495 0.92 ALDH1A1 (0.46) HPGDALDH1A1NPC1RAB9ASMN1; SMN2
SCHEMBL8869753 0.90 NPC1 (0.50) HPGDALDH1A1NPC1RAB9ASMN1; SMN2
SCHEMBL9018349 0.89 ALDH1A1 (0.49) HPGDALDH1A1NPC1RAB9ASMN1; SMN2
SCHEMBL7867895 0.88 NPC1 (0.51) HPGDNPC1RAB9ASMN1; SMN2BCL2L1
SCHEMBL7870551 0.87 RAB9A (0.49) HPGDNPC1RAB9ASMN1; SMN2BCL2L1
SCHEMBL7870537 0.87 POLB (0.41) HPGDALDH1A1NPC1RAB9ASMN1; SMN2
SCHEMBL9018281 0.86 ALDH1A1 (0.47) HPGDALDH1A1NPC1RAB9ASMN1; SMN2
SCHEMBL7867692 0.85 SMN1; SMN2 (0.44) HPGDNPC1RAB9ASMN1; SMN2CA1
SCHEMBL8869616 0.84 HPGD (0.52) HPGDALDH1A1NPC1RAB9ASMN1; 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