SCHEMBL8868431

SCHEMBL8868431

CCCCCOC(=O)CNC(=O)c1ccc(C(=O)NS(=O)(=O)CCc2ccc(OC)cc2)cn1

nearest known ligand 0.44

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 4/20 0.43
MEN1 O00255 2/20 0.43
P4HTM Q9NXG6 2/20 0.43
POLB P06746 1/20 0.42
MMP8 P22894 1/20 0.42
MMP12 P39900 1/20 0.42
MMP13 P45452 1/20 0.42
ALDH1A1 P00352 1/20 0.40
CNR2 P34972 1/20 0.40
PPARG P37231 1/20 0.39
MMP1 P03956 1/20 0.39
CA2 P00918 1/20 0.39
TP53 P04637 1/20 0.38
MAPT P10636 1/20 0.38
GAA P10253 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
SCHEMBL8870177 0.94 KMT2A (0.46) KMT2AMEN1P4HTMPOLBMMP8
SCHEMBL8867821 0.91 CXCR1 (0.40) KMT2AMEN1P4HTMPOLBCNR2
SCHEMBL8869544 0.85 ALDH1A1 (0.49) KMT2AMEN1P4HTMMMP8MMP12
SCHEMBL8868434 0.84 KMT2A (0.45) KMT2AMEN1P4HTMPOLBMMP8
SCHEMBL8870184 0.84 KMT2A (0.46) KMT2AMEN1P4HTMPOLBMMP8
SCHEMBL8869549 0.84 P4HTM (0.50) KMT2AMEN1P4HTMPOLBMMP8
SCHEMBL8869086 0.83 P4HTM (0.45) P4HTMPOLBMMP1TP53
SCHEMBL8869538 0.83 KMT2A (0.55) KMT2AMEN1P4HTMPOLBMMP8
SCHEMBL9140185 0.82 P4HTM (0.48) KMT2AMEN1P4HTMMMP8MMP12
SCHEMBL8869643 0.82 KMT2A (0.56) KMT2AMEN1P4HTMPOLBMMP8

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5607954-A Sulfonamido- and sulfonamidocarbonylpyridine-2-carboxamides and their pyridine-n-oxides, process for their preparation and their use as pharmaceuticals HOECHST AKTIENGESELLSCHAFT (DE) 1997-03-04 US disclosed