SCHEMBL11523185

SCHEMBL11523185

CC(=O)Nc1ccc(S(=O)(=O)Oc2ccc(Cl)cc2C)cc1N

nearest known ligand 0.63

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ KMT2A Q03164 4/20 0.63
▸ NPC1 O15118 1/20 0.51
▸ MEN1 O00255 3/20 0.47
▸ HTT P42858 1/20 0.47
▸ HDAC1 Q13547 1/20 0.46
▸ CA1 P00915 4/20 0.44
▸ CA2 P00918 4/20 0.44
▸ CA9 Q16790 4/20 0.44
▸ MAPK1 P28482 3/20 0.44
▸ ALDH1A1 P00352 2/20 0.43
▸ MAPT P10636 2/20 0.43
▸ GAA P10253 1/20 0.42
▸ KDM4E B2RXH2 2/20 0.41
▸ HSD17B10 Q99714 1/20 0.41
▸ APP P05067 1/20 0.40
▸ HPGD P15428 1/20 0.39
▸ SMN1; SMN2 Q16637 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
SCHEMBL11520129 0.91 KMT2A (0.60) KMT2ANPC1MEN1HTTHDAC1
SCHEMBL11522873 0.90 KMT2A (0.61) KMT2ANPC1MEN1HDAC1CA1
SCHEMBL11522363 0.87 KMT2A (0.58) KMT2ANPC1MEN1HTTHDAC1
SCHEMBL11522752 0.84 KMT2A (0.60) KMT2ANPC1MEN1HTTCA1
SCHEMBL11518189 0.83 KMT2A (0.64) KMT2ANPC1MEN1HDAC1CA1
SCHEMBL11519854 0.83 KMT2A (0.50) KMT2ANPC1MEN1HTTHDAC1
SCHEMBL11523234 0.82 KMT2A (0.57) KMT2ANPC1MEN1HTTHDAC1
SCHEMBL11449087 0.81 KMT2A (0.45) KMT2AMEN1HTTALDH1A1MAPT
SCHEMBL11521761 0.81 NPC1 (0.53) KMT2ANPC1MEN1HTTHDAC1
SCHEMBL11520297 0.81 NPC1 (0.55) KMT2ANPC1MEN1HDAC1CA1

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-4176192-A ANTHELMINTICS HOECHST AKTIENGESELLSCHAFT (DE) 1979-11-27 — — US disclosed
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