SCHEMBL13559554

SCHEMBL13559554

CNC(=O)c1cc(Oc2ccc3c(c2)nc(Nc2ccc(Cl)c(-c4cncc(C)c4)c2)n3C)ccn1

nearest known ligand 0.69

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
RAF1 P04049 19/20 0.69
BRAF P15056 17/20 0.69
KDR P35968 2/20 0.64
LCK P06239 1/20 0.60
FYN P06241 1/20 0.60
PDGFRB P09619 1/20 0.60
KIT P10721 1/20 0.60
FLT1 P17948 1/20 0.60
FLT4 P35916 1/20 0.60

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
SCHEMBL13504182 0.92 RAF1 (0.68) RAF1BRAFKDRLCKFYN
SCHEMBL2889750 0.92 RAF1 (0.70) RAF1BRAFKDRLCKFYN
SCHEMBL2886257 0.91 RAF1 (0.75) RAF1BRAFKDRLCKFYN
SCHEMBL13504359 0.90 RAF1 (0.72) RAF1BRAFKDRLCKFYN
SCHEMBL2892351 0.88 RAF1 (0.71) RAF1BRAFKDRLCKFYN
SCHEMBL13559553 0.88 RAF1 (0.69) RAF1BRAFKDRLCKFYN
SCHEMBL2895074 0.88 RAF1 (0.73) RAF1BRAFKDRLCKFYN
SCHEMBL2887114 0.87 RAF1 (0.68) RAF1BRAFKDRLCKFYN
SCHEMBL13504239 0.87 RAF1 (0.70) RAF1BRAFKDRLCKFYN
SCHEMBL13504296 0.87 RAF1 (0.70) RAF1BRAFKDRLCKFYN

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
US-8299108-B2 for treatment of hematological/hormone-dependent cancer NOVARTIS AG (CH) 2012-10-30 US disclosed
US-8299108-B2 for treatment of hematological/hormone-dependent cancer NOVARTIS AG (CH) 2012-10-30 US disclosed