SCHEMBL7867692

SCHEMBL7867692

O=C(NCCO)Oc1ccc(C(=O)NS(=O)(=O)c2ccc(C(=O)NCCOc3ccccc3)cc2Cl)cn1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 6/20 0.44
CA1 P00915 1/20 0.44
CA2 P00918 1/20 0.44
CA9 Q16790 1/20 0.44
NPC1 O15118 10/20 0.42
RAB9A P51151 9/20 0.41
HPGD P15428 2/20 0.41
POLB P06746 2/20 0.41
CASP3 P42574 1/20 0.41
SENP7 Q9BQF6 1/20 0.41
TP53 P04637 1/20 0.40
MAPK1 P28482 1/20 0.40
PTGDR Q13258 1/20 0.40
PTGDR2 Q9Y5Y4 1/20 0.40
ROCK2 O75116 1/20 0.40
RECQL P46063 1/20 0.39
CXCR3 P49682 1/20 0.39
HTT P42858 1/20 0.39
GABRA5 P31644 1/20 0.38
BCL2L1 Q07817 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
SCHEMBL7867672 0.93 SMN1; SMN2 (0.44) SMN1; SMN2CA1CA2CA9NPC1
SCHEMBL7862675 0.91 SMN1; SMN2 (0.45) SMN1; SMN2CA1CA2CA9NPC1
SCHEMBL7874281 0.91 SMN1; SMN2 (0.43) SMN1; SMN2CA1CA2CA9NPC1
SCHEMBL8868242 0.90 SMN1; SMN2 (0.48) SMN1; SMN2CA1CA2CA9NPC1
SCHEMBL7870551 0.87 RAB9A (0.49) SMN1; SMN2NPC1RAB9AHPGDPOLB
SCHEMBL7867895 0.86 NPC1 (0.51) SMN1; SMN2NPC1RAB9AHPGDPOLB
SCHEMBL7874624 0.86 PTGDR (0.42) SMN1; SMN2NPC1RAB9AHPGDPOLB
SCHEMBL7862784 0.85 HPGD (0.46) SMN1; SMN2CA1CA2CA9NPC1
SCHEMBL8868389 0.84 SMN1; SMN2 (0.48) SMN1; SMN2CA1CA2CA9NPC1
SCHEMBL7867910 0.83 PTGDR2 (0.45) SMN1; SMN2NPC1RAB9AHPGDTP53

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