SCHEMBL7867957

SCHEMBL7867957

COc1ccc(Cl)c(C(=O)NCCc2ccc(S(=O)(=O)NC(=O)c3ccc(OC(=O)NCCOC(C)=O)nc3)cc2)c1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 2/20 0.47
MEN1 O00255 1/20 0.47
ALDH1A1 P00352 2/20 0.45
SMN1; SMN2 Q16637 2/20 0.45
LMNA P02545 2/20 0.45
HTT P42858 1/20 0.45
MAPT P10636 1/20 0.44
NLRP3 Q96P20 2/20 0.42
P4HTM Q9NXG6 1/20 0.41
ABCC8 Q09428 1/20 0.40
CA12 O43570 2/20 0.40
CA1 P00915 2/20 0.40
CA2 P00918 2/20 0.40
CA9 Q16790 1/20 0.40
CA4 P22748 1/20 0.40
CA5A P35218 1/20 0.40
CA7 P43166 1/20 0.40
CA5B Q9Y2D0 1/20 0.40
RAB9A P51151 1/20 0.40
FLT1 P17948 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
SCHEMBL7867898 0.94 KMT2A (0.50) KMT2AMEN1ALDH1A1SMN1; SMN2LMNA
SCHEMBL8867833 0.91 P4HTM (0.49) KMT2AMEN1ALDH1A1SMN1; SMN2LMNA
SCHEMBL7867892 0.91 KMT2A (0.50) KMT2AMEN1ALDH1A1SMN1; SMN2LMNA
SCHEMBL9574900 0.90 LMNA (0.45) KMT2AMEN1ALDH1A1SMN1; SMN2LMNA
SCHEMBL7871643 0.88 KMT2A (0.51) KMT2AMEN1ALDH1A1SMN1; SMN2LMNA
SCHEMBL7862785 0.88 LMNA (0.52) KMT2AMEN1ALDH1A1SMN1; SMN2LMNA
SCHEMBL7867689 0.87 KMT2A (0.45) KMT2AMEN1ALDH1A1SMN1; SMN2LMNA
SCHEMBL7874545 0.87 NLRP3 (0.60) KMT2AMEN1ALDH1A1LMNAMAPT
SCHEMBL9018558 0.87 ALDH1A1 (0.48) KMT2AMEN1ALDH1A1SMN1; SMN2LMNA
SCHEMBL7871602 0.86 KMT2A (0.48) KMT2AMEN1ALDH1A1SMN1; SMN2LMNA

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