SCHEMBL20057568

SCHEMBL20057568

CNc1cccc(NC(=O)N(C)C)c1

nearest known ligand 0.69

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
TP53 P04637 1/20 0.61
PNPLA2 Q96AD5 1/20 0.58
HDAC6 Q9UBN7 1/20 0.58
APEX1 P27695 1/20 0.54
TSHR P16473 1/20 0.50
KDM4E B2RXH2 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
SCHEMBL19019393 0.92 TP53 (0.69) TP53PNPLA2HDAC6APEX1TSHR
SCHEMBL30888839 0.82 TP53 (0.58) TP53PNPLA2HDAC6APEX1TSHR
SCHEMBL8153658 0.81 HSD17B10 (0.65) TP53PNPLA2HDAC6APEX1
SCHEMBL10425058 0.81 ALDH1A1 (0.65) TP53PNPLA2HDAC6APEX1TSHR
SCHEMBL11164480 0.81 TP53 (0.61) TP53PNPLA2HDAC6APEX1TSHR
SCHEMBL10705800 0.81 TP53 (0.56) TP53PNPLA2HDAC6APEX1TSHR
SCHEMBL11862075 0.81 POLB (0.68) TP53PNPLA2HDAC6
SCHEMBL11878225 0.81 NPSR1 (0.61) TP53PNPLA2HDAC6APEX1KDM4E
SCHEMBL23169533 0.80 TP53 (0.64) TP53PNPLA2HDAC6APEX1TSHR
SCHEMBL10808693 0.80 TP53 (0.59) TP53PNPLA2HDAC6APEX1TSHR

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-3309146-A1 SULFONAMIDE DERIVATIVE AND PHARMACEUTICALLY ACCEPTABLE ACID ADDITION SALT THEREOF University of Tsukuba (JP) 2018-04-18 EP disclosed