SCHEMBL4415499

SCHEMBL4415499

CCOC(=O)c1c[nH]c(C(F)(F)F)nc1=O

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.50
KMT2A Q03164 2/20 0.50
KDM4E B2RXH2 6/20 0.49
NPSR1 Q6W5P4 1/20 0.47
ALDH1A1 P00352 2/20 0.45
HPGD P15428 1/20 0.45
HSD17B10 Q99714 1/20 0.45
L3MBTL1 Q9Y468 2/20 0.44
LMNA P02545 1/20 0.43
MAPT P10636 1/20 0.43
CLEC4M Q9H2X3 1/20 0.43
CYP1A2 P05177 1/20 0.42
CYP3A4 P08684 1/20 0.42
CYP2C19 P33261 1/20 0.42
JAK2 O60674 2/20 0.42
JAK3 P52333 2/20 0.42
GABRA1 P14867 1/20 0.41
GABRB2 P47870 1/20 0.41
FOS P01100 2/20 0.41
JUN P05412 2/20 0.41

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
SCHEMBL13733621 0.81 CYP1A2 (0.47) MEN1KMT2AKDM4ENPSR1ALDH1A1
SCHEMBL15215750 0.80 KMT2A (0.52) MEN1KMT2AKDM4EALDH1A1HPGD
SCHEMBL4376723 0.78 KDM4E (0.49) MEN1KMT2AKDM4ENPSR1ALDH1A1
SCHEMBL2845477 0.78 MEN1 (0.50) MEN1KMT2AKDM4EALDH1A1HPGD
SCHEMBL15015768 0.75 MEN1 (0.51) MEN1KMT2AKDM4ENPSR1ALDH1A1
SCHEMBL4415502 0.74 KDM4E (0.61) MEN1KMT2AKDM4ENPSR1ALDH1A1
SCHEMBL25238639 0.73 KDM4E (0.50) MEN1KMT2AKDM4ENPSR1ALDH1A1
SCHEMBL29109948 0.72 ALDH1A1 (0.49) KMT2AKDM4EALDH1A1HPGDHSD17B10
SCHEMBL23361072 0.72 KDM4E (0.49) MEN1KMT2AKDM4ENPSR1HPGD
SCHEMBL11013234 0.70 ALDH1A1 (0.50) MEN1KMT2AKDM4EALDH1A1HPGD

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 6 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1479671-B1 Pyrimidinone compounds SMITHKLINE BEECHAM PLC (GB) 2009-05-27 EP disclosed
EP-1479671-A1 Pyrimidinone compounds SMITHKLINE BEECHAM PLC (GB) 2004-11-24 EP disclosed
EP-1175408-A1 PYRIMIDINONE COMPOUNDS SMITHKLINE BEECHAM PLC (GB) 2002-01-30 EP disclosed
EP-1173424-A1 PYRIMIDINE COMPOUNDS SMITHKLINE BEECHAM PLC (GB) 2002-01-23 EP disclosed
WO-2000066567-A1 PYRIMIDINONE COMPOUNDS SMITHKLINE BEECHAM PLC (GB) 2000-11-09 WO disclosed
WO-2000066566-A1 PYRIMIDINE COMPOUNDS SMITHKLINE BEECHAM PLC (GB) 2000-11-09 WO disclosed