SCHEMBL10468596

SCHEMBL10468596

CCCCOC(=O)c1cc(C(F)(F)F)c(O)nc1NC1CCC1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NR2F2 P24468 2/20 0.39
NPSR1 Q6W5P4 2/20 0.39
SYK P43405 1/20 0.39
KDM4E B2RXH2 1/20 0.39
MAPT P10636 1/20 0.39
MAPK1 P28482 1/20 0.39
MEN1 O00255 1/20 0.39
NPC1 O15118 1/20 0.39
S1PR2 O95136 1/20 0.39
ALDH1A1 P00352 1/20 0.39
LMNA P02545 1/20 0.39
XBP1 P17861 1/20 0.39
RAB9A P51151 1/20 0.39
PPP1CA P62136 1/20 0.39
KMT2A Q03164 1/20 0.39
FLT3 P36888 2/20 0.38
TYRO3 Q06418 2/20 0.38
MERTK Q12866 2/20 0.38
GAS6 Q14393 2/20 0.38
ULK1 O75385 1/20 0.37

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
SCHEMBL10467342 0.96 FLT3 (0.40) SYKFLT3TYRO3MERTKGAS6
SCHEMBL10469415 0.94 NR2F2 (0.41) NR2F2NPSR1SYKKDM4EMAPT
SCHEMBL10468535 0.89 KDM4E (0.48) NR2F2NPSR1SYKKDM4EMAPT
SCHEMBL10469377 0.89 NR2F2 (0.38) NR2F2NPSR1SYKKDM4EMAPT
SCHEMBL10467083 0.87 NR2F2 (0.42) NR2F2NPSR1KDM4EMAPTMAPK1
SCHEMBL10468707 0.86 ESR1 (0.43) NR2F2NPSR1KDM4EMAPTMAPK1
SCHEMBL10468781 0.85 KDM4E (0.45) NR2F2NPSR1SYKKDM4EMAPT
SCHEMBL10467366 0.85 ULK1 (0.43) SYKFLT3MERTKULK1
SCHEMBL10466965 0.84 ESR1 (0.46) NR2F2NPSR1KDM4EMAPTMAPK1
SCHEMBL10468245 0.84 ESR1 (0.43) MAPK1LMNATSHRTDP1L3MBTL1

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-4916229-A Pyridine carboxylic acid derivates WARNER-LAMBERT COMPANY (US) 1990-04-10 US disclosed