SCHEMBL2434130

SCHEMBL2434130

Nc1nc(Cl)cc(Oc2ccc3c(c2)OCN3C(=O)Nc2ccc(F)c(C(F)(F)F)c2)n1

nearest known ligand 0.45

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
KDR P35968 15/20 0.45
FLT1 P17948 2/20 0.45
FLT4 P35916 2/20 0.45
KCNH2 Q12809 1/20 0.41
CDK8 P49336 2/20 0.41
MEN1 O00255 1/20 0.39
KMT2A Q03164 1/20 0.39
RORC P51449 1/20 0.39
BRAF P15056 3/20 0.38

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
SCHEMBL2434370 0.89 KDR (0.59) KDRFLT1FLT4KCNH2CDK8
SCHEMBL2434309 0.87 KDR (0.50) KDRFLT1FLT4KCNH2BRAF
SCHEMBL2434342 0.86 KDR (0.60) KDRFLT1FLT4KCNH2CDK8
SCHEMBL2435966 0.84 KDR (0.57) KDRFLT1FLT4KCNH2CDK8
SCHEMBL273466 0.78 KDR (0.54) KDRFLT1FLT4CDK8MEN1
SCHEMBL2707864 0.78 MEN1 (0.49) KDRMEN1KMT2A
SCHEMBL2437298 0.77 AR (0.41) KDRCDK8RORCBRAF
SCHEMBL12972418 0.77 KDR (0.52) KDRCDK8
SCHEMBL2432193 0.76 KDR (0.56) KDRFLT1FLT4KCNH2CDK8
SCHEMBL2437389 0.75 GRM4 (0.41) CDK8RORC

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