SCHEMBL9229178

SCHEMBL9229178

CC(=O)c1ccc(S(=O)(=O)c2ccc(NC(C)(C)C)cc2)cc1

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 6/20 0.57
▸ KMT2A Q03164 4/20 0.57
▸ LMNA P02545 3/20 0.57
▸ KDM4E B2RXH2 1/20 0.57
▸ MAPK1 P28482 1/20 0.57
▸ ALDH1A1 P00352 6/20 0.54
▸ MEN1 O00255 3/20 0.54
▸ CA12 O43570 2/20 0.50
▸ CA9 Q16790 2/20 0.50
▸ HPGD P15428 2/20 0.50
▸ CA1 P00915 1/20 0.50
▸ CA2 P00918 1/20 0.50
▸ SMN1; SMN2 Q16637 3/20 0.49
▸ GAA P10253 2/20 0.49
▸ TP53 P04637 1/20 0.49
▸ THRB P10828 1/20 0.49
▸ ATM Q13315 1/20 0.47
▸ PKM P14618 2/20 0.46
▸ USP2 O75604 1/20 0.46
▸ TSHR P16473 1/20 0.46

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
SCHEMBL12883549 0.88 MAPT (0.50) MAPTKMT2ALMNAMAPK1ALDH1A1
SCHEMBL13884294 0.86 ALDH1A1 (0.55) MAPTKMT2ALMNAKDM4EMAPK1
SCHEMBL9234891 0.83 PKM (0.68) MAPTKMT2AKDM4EALDH1A1MEN1
SCHEMBL4027167 0.82 MAPT (0.61) MAPTKMT2ALMNAKDM4EMAPK1
SCHEMBL9230987 0.79 GAA (0.61) MAPTKMT2AKDM4EALDH1A1MEN1
SCHEMBL9228703 0.79 HTR6 (0.54) MAPTKMT2ALMNAKDM4EMAPK1
SCHEMBL9228034 0.79 MAPT (0.42) MAPTKMT2ALMNAKDM4EMAPK1
SCHEMBL23239821 0.78 KMT2A (0.57) MAPTKMT2ALMNAKDM4EMAPK1
SCHEMBL9231499 0.78 HPGD (0.66) MAPTKMT2ALMNAMAPK1ALDH1A1
Hydrochloric Acid SCHEMBL9231987 0.77 HTR6 (0.52) MAPTKMT2ALMNAKDM4EMAPK1

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
EP-0666253-A1 N-t-BUTYLANILINE ANALOG AND LIPID LEVEL DEPRESSANT CONTAINING THE SAME TAISHO PHARMACEUTICAL CO. LTD (JP) 1995-08-09 — — EP disclosed
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