SCHEMBL14865205

SCHEMBL14865205

NC1CC(Oc2ccc(NC(=O)C3(C(=O)O)CC3)c(F)c2)CC=N1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DGAT1 O75907 1/20 0.36
SOAT1 P35610 1/20 0.36
HRH3 Q9Y5N1 1/20 0.34
MET P08581 6/20 0.34
KDR P35968 5/20 0.34
NTRK1 P04629 3/20 0.34
EPHB4 P54760 3/20 0.34
FLT3 P36888 2/20 0.34
EPHB6 O15197 1/20 0.34
RIPK2 O43353 1/20 0.34
ABL1 P00519 1/20 0.34
LCK P06239 1/20 0.34
LYN P07948 1/20 0.34
RET P07949 1/20 0.34
HCK P08631 1/20 0.34
PDGFRB P09619 1/20 0.34
BCR P11274 1/20 0.34
EPHA2 P29317 1/20 0.34
EPHB2 P29323 1/20 0.34
ABL2 P42684 1/20 0.34

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
SCHEMBL3557591 0.70 RAB9A (0.51) METALDH1A1GAA
SCHEMBL3561475 0.69 RAF1 (0.47) METKDRNTRK1EPHB4FLT3
SCHEMBL15458165 0.68 KDR (0.51) METKDRNTRK1EPHB4FLT3
SCHEMBL14865203 0.67 KDR (0.37) METKDRNTRK1EPHB4FLT3
SCHEMBL307269 0.65 RAB9A (0.55) ALDH1A1GAA
SCHEMBL30074389 0.63 HTT (0.54) METALDH1A1GAA
SCHEMBL2413206 0.62 AXL (0.56) METKDRFLT3PDGFRBAXL
SCHEMBL13635722 0.62 MET (0.53) METKDRNTRK1EPHB4FLT3
SCHEMBL2151713 0.61 HTT (0.49) METALDH1A1GAA
SCHEMBL28520687 0.61 THRB (0.51) METALDH1A1GAA

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-2058302-B1 METHOD FOR PRODUCING PHENOXYPYRIDINE DERIVATIVE EISAI R&D MAN CO LTD (JP) 2013-04-17 EP disclosed