SCHEMBL8870946

SCHEMBL8870946

O=C(COc1ccccc1)Nc1ccc(S(=O)(=O)NC(=O)c2ccc(C(=O)NCCO)nc2)cc1

nearest known ligand 0.55

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.55
HPGD P15428 1/20 0.55
P4HTM Q9NXG6 3/20 0.52
KMT2A Q03164 2/20 0.52
SGMS1 Q86VZ5 3/20 0.48
NAMPT P43490 1/20 0.48
POLB P06746 3/20 0.47
MEN1 O00255 1/20 0.46
MAPT P10636 3/20 0.46
GAA P10253 1/20 0.46
NPSR1 Q6W5P4 1/20 0.46
MLYCD O95822 1/20 0.45

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
SCHEMBL7871607 0.88 ALDH1A1 (0.52) ALDH1A1HPGDP4HTMKMT2ASGMS1
SCHEMBL8867352 0.87 POLB (0.52) ALDH1A1P4HTMSGMS1POLBGAA
SCHEMBL8868396 0.87 HDAC3 (0.54) ALDH1A1P4HTMKMT2APOLBMEN1
SCHEMBL9140161 0.87 ALDH1A1 (0.59) ALDH1A1HPGDP4HTMKMT2ANAMPT
SCHEMBL8869092 0.85 P4HTM (0.59) P4HTM
SCHEMBL8869119 0.85 L3MBTL1 (0.56) ALDH1A1P4HTMKMT2ANAMPTMEN1
SCHEMBL8869710 0.85 P4HTM (0.56) HPGDP4HTMKMT2APOLBMEN1
SCHEMBL8868261 0.84 P4HTM (0.49) ALDH1A1P4HTMKMT2AMEN1GAA
SCHEMBL8867590 0.84 P4HTM (0.72) ALDH1A1P4HTM
SCHEMBL8868551 0.83 P4HTM (0.47) ALDH1A1P4HTMKMT2AMEN1MAPT

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