SCHEMBL5264772

SCHEMBL5264772

CNc1ncnc(-c2cccnc2Oc2cc(C(=O)Nc3cc(OCC4CCCN4C)cc(C(F)(F)F)c3)ccc2C)n1

nearest known ligand 0.67

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TEK Q02763 19/20 0.67
KDR P35968 16/20 0.67
JAK2 O60674 1/20 0.57
EGFR P00533 1/20 0.57
LCK P06239 1/20 0.57
IGF1R P08069 1/20 0.57
MET P08581 1/20 0.57
KIT P10721 1/20 0.57
FGFR1 P11362 1/20 0.57
SRC P12931 1/20 0.57
FGFR2 P21802 1/20 0.57
FGFR4 P22455 1/20 0.57
FGFR3 P22607 1/20 0.57
ZAP70 P43403 1/20 0.57
MAPK10 P53779 1/20 0.57
BTK Q06187 1/20 0.57
MAPK14 Q16539 1/20 0.57
YES1 P07947 1/20 0.55
MAP3K7 O43318 1/20 0.47
MAP4K2 Q12851 1/20 0.47

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
SCHEMBL1267447 1.00 TEK (0.67) TEKKDRJAK2EGFRLCK
SCHEMBL5261502 0.92 TEK (0.67) TEKKDRLCKKITSRC
SCHEMBL12894949 0.92 TEK (0.67) TEKKDRLCKKITSRC
SCHEMBL1265559 0.92 TEK (0.67) TEKKDRLCKKITSRC
SCHEMBL5260763 0.88 TEK (0.63) TEKKDRJAK2EGFRLCK
SCHEMBL1265162 0.88 TEK (0.63) TEKKDRJAK2EGFRLCK
SCHEMBL5264046 0.85 TEK (0.62) TEKKDRLCKKITSRC
SCHEMBL1265075 0.85 TEK (0.62) TEKKDRLCKKITSRC
SCHEMBL1264244 0.85 TEK (0.80) TEKKDRJAK2EGFRLCK
SCHEMBL5261772 0.85 TEK (0.62) TEKKDRLCKKITSRC

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1751136-A2 NITROGENATED HETEROCYCLIC DERIVATIVES AS PROTEIN KINASE MODULATORS AND USE FOR THE TREATMENT OF ANGIOGENESIS AND CANCER AMGEN INC. (US) 2007-02-14 EP claimed
WO-2005113494-A2 NITROGENATED HETEROCYCLIC DERIVATIVES AS PROTEIN KINASE MODULATORS AND USE FOR THE TREATMENT OF ANGIOGENESIS AND CANCER AMGEN INC. (US) 2005-12-01 WO claimed