SCHEMBL14006708

SCHEMBL14006708

Nc1cc(-c2cccc(C(F)(F)F)c2)cn2ccnc12

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAOB P27338 1/20 0.44
EPHB4 P54760 11/20 0.43
KDM4E B2RXH2 3/20 0.42
ALDH1A1 P00352 1/20 0.42
ABL1 P00519 1/20 0.42
EGFR P00533 1/20 0.42
PRKCB P05771 1/20 0.42
INSR P06213 1/20 0.42
LCK P06239 1/20 0.42
FYN P06241 1/20 0.42
LYN P07948 1/20 0.42
PDGFRB P09619 1/20 0.42
SRC P12931 1/20 0.42
PRKCA P17252 1/20 0.42
FLT1 P17948 1/20 0.42
FGFR4 P22455 1/20 0.42
EPHA2 P29317 1/20 0.42
AKT1 P31749 1/20 0.42
FLT4 P35916 1/20 0.42
KDR P35968 1/20 0.42

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
SCHEMBL14006694 0.79 ADORA2A (0.43) KDM4EALDH1A1FLT1KDRFLT3
SCHEMBL14006703 0.79 HDAC6 (0.50) EPHB4ABL1EGFRSRCKDR
SCHEMBL30256773 0.78 GRM5 (0.43) EPHB4KDM4EALDH1A1ABL1EGFR
SCHEMBL14006717 0.78 MC4R (0.60) EPHB4ABL1EGFRPRKCBINSR
SCHEMBL14006700 0.76 ALOX5AP (0.43) TLR8KMOADORA2A
SCHEMBL14382359 0.75 MAOB (0.44) MAOBKDM4EXDHTLR8ADORA2A
SCHEMBL1419883 0.75 NPC1 (0.53) KDM4EALDH1A1XDHTLR8ADORA2A
SCHEMBL15411397 0.74 PTPN11 (0.42) MAOBEPHB4KDM4EABL1EGFR
SCHEMBL15743496 0.73 GRM5 (0.40) EPHB4ADORA2A
SCHEMBL1420319 0.72 KMO (0.54) EPHB4ABL1EGFRPRKCBINSR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7452902-B2 Imidazopyridines as cyclin dependent kinase inhibitors SCHERING CORPORATION (US) 2008-11-18 US disclosed
US-7452902-B2 Imidazopyridines as cyclin dependent kinase inhibitors SCHERING CORPORATION (US) 2008-11-18 US disclosed
EP-1539756-B1 IMIDAZOPYRIDINES AS CYCLIN DEPENDENT KINASE INHIBITORS SCHERING CORP (US) 2007-11-14 EP disclosed