SCHEMBL5324128

SCHEMBL5324128

CNC(=O)c1c(C)[nH]c2ccc(O)c(F)c12

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
BRD4 O60885 2/20 0.36
BRPF1 P55201 2/20 0.36
CREBBP Q92793 2/20 0.36
EGFR P00533 2/20 0.35
SRC P12931 1/20 0.35
ERN1 O75460 1/20 0.35
KDM5A P29375 1/20 0.35
NR4A2 P43354 1/20 0.34
GAA P10253 4/20 0.34
MAPT P10636 2/20 0.33
EP300 Q09472 1/20 0.33
PKM P14618 1/20 0.33
RXFP1 Q9HBX9 1/20 0.33
KDM4E B2RXH2 1/20 0.32
MEN1 O00255 1/20 0.32
KMT2A Q03164 1/20 0.32
ALDH1A1 P00352 1/20 0.31
KLK7 P49862 1/20 0.31
L3MBTL1 Q9Y468 1/20 0.31
WDR5 P61964 1/20 0.31

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
SCHEMBL7832660 0.78 ADRB2 (0.46) BRD4BRPF1CREBBPGAAMAPT
SCHEMBL17447389 0.76 TTR (0.37) ERN1NR4A2GAAMAPTKDM4E
SCHEMBL16065345 0.76 PDE3B (0.38) ERN1HTR1DHTR2AHTR2CHTR7
SCHEMBL21884849 0.73 AR (0.36) ERN1GAAMAPTMEN1KMT2A
SCHEMBL15546942 0.72 PKM (0.39) NR4A2GAAMAPTPKMRXFP1
SCHEMBL2462946 0.71 KDM4E (0.51) GAAMAPTKDM4EMEN1KMT2A
SCHEMBL12255399 0.70 EGFR (0.39) EGFRGAAMAPTRXFP1KDM4E
SCHEMBL7832691 0.70 GAA (0.61) EGFRSRCNR4A2GAAMAPT
SCHEMBL14487045 0.67 EGFR (0.67) EGFRSRCNR4A2GAAMAPT
SCHEMBL30608287 0.67 EGFR (0.67) EGFRSRCNR4A2GAAMAPT

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
WO-2007109783-A2 SUBSTITUTED PYRIMIDINE KINASE INHIBITORS JANSSEN PHARMACEUTICA, N.V. (BE) 2007-09-27 WO disclosed