SCHEMBL2434299

SCHEMBL2434299

CC(C)N1CCN(Cc2ccc(NC(=O)c3nccc4cc(Oc5cc(Cl)ncn5)ccc34)cc2C(F)(F)F)CC1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SRC P12931 6/20 0.51
ABL1 P00519 6/20 0.51
HCK P08631 6/20 0.51
MKNK2 Q9HBH9 4/20 0.51
MAP3K7 O43318 4/20 0.51
MAP4K2 Q12851 4/20 0.51
MAPK14 Q16539 4/20 0.51
MKNK1 Q9BUB5 3/20 0.51
CDK2 P24941 2/20 0.51
CDK8 P49336 2/20 0.51
FES P07332 2/20 0.51
FER P16591 2/20 0.51
BCR P11274 2/20 0.51
FGFR1 P11362 2/20 0.51
KDR P35968 2/20 0.51
MAP3K20 Q9NYL2 2/20 0.51
STK25 O00506 1/20 0.51
CIT O14578 1/20 0.51
MAP2K7 O14733 1/20 0.51
IKBKB O14920 1/20 0.51

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
SCHEMBL2435267 0.92 CDK2 (0.58) SRCABL1HCKMKNK2MAP3K7
SCHEMBL2437272 0.92 HCK (0.53) SRCABL1HCKMKNK2MAP3K7
SCHEMBL2434445 0.91 HCK (0.54) SRCABL1HCKMKNK2MAP3K7
SCHEMBL4933283 0.85 SRC (0.69) SRCABL1HCKMKNK2MAP3K7
SCHEMBL2434003 0.84 HCK (0.55) SRCABL1HCKMKNK2MAP3K7
SCHEMBL2435174 0.84 HCK (0.56) SRCABL1HCKMKNK2MAP3K7
SCHEMBL2437280 0.82 KDR (0.67) SRCABL1HCKMKNK2MAP3K7
SCHEMBL2434611 0.81 KDR (0.53) SRCABL1HCKMKNK2MAP3K7
SCHEMBL2431407 0.81 KDR (0.62) KDRRAF1RETPDGFRBKIT
SCHEMBL2433219 0.81 KDR (0.54) SRCABL1HCKMKNK2MAP3K7

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-8026247-B2 Bicyclic amides as kinase inhibitors NOVARTIS AG (CH) 2011-09-27 US disclosed