SCHEMBL2926080

SCHEMBL2926080

COc1cc2ncnc(-c3ccc(N)c(F)c3N)c2cc1OC

nearest known ligand 0.67

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
KIT P10721 7/20 0.67
EGFR P00533 6/20 0.52
TRPA1 O75762 1/20 0.44
PDE10A Q9Y233 1/20 0.43
KDR P35968 5/20 0.43
RET P07949 4/20 0.43
FLT1 P17948 1/20 0.43
KIF5B P33176 3/20 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
SCHEMBL371765 0.84 KIT (0.67) KITEGFRTRPA1PDE10AKDR
SCHEMBL15504611 0.81 KIT (1.00) KITEGFRTRPA1KDRRET
SCHEMBL8172203 0.79 KIT (0.59) KITEGFRKDRRET
SCHEMBL15516134 0.78 KIT (1.00) KITEGFRTRPA1KDRRET
SCHEMBL7714348 0.76 KIT (0.74) KITEGFRTRPA1PDE10AKDR
SCHEMBL5665515 0.75 KIT (0.58) KITEGFRKDRRETKIF5B
SCHEMBL4974935 0.75 KIT (0.58) KITEGFRKDRRETFLT1
SCHEMBL1264612 0.74 KIT (0.60) KITEGFRTRPA1PDE10AKDR
SCHEMBL6182709 0.73 KIT (0.59) KITEGFRKDRRET
SCHEMBL5569432 0.72 KIT (0.69) KITEGFRKDRRETFLT1

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-2213661-A1 c-Met Modulators and Methods of Use Exelixis Inc. (US) 2010-08-04 EP disclosed
EP-2210607-A1 N-[3-fluoro-4-({6-(methyloxy)-7-[(3-piperidin-1-ylpropyl)oxy]quinolin-4-yl}oxy)phenyl]-N'-(4-fluorophenyl)cyclopropane-1,1-dicarboxamide for the treatment of cancer Exelixis Inc. (US) 2010-07-28 EP disclosed