SCHEMBL1660412

SCHEMBL1660412

CNC(=O)c1cc(Oc2ccc(NC(=O)Nc3cc(Br)ccc3F)c(F)c2)ccn1

nearest known ligand 0.63

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ABL1 P00519 5/20 0.63
RAF1 P04049 8/20 0.62
BRAF P15056 7/20 0.62
KDR P35968 7/20 0.62
MAPK14 Q16539 6/20 0.62
RET P07949 3/20 0.62
MAP3K20 Q9NYL2 3/20 0.62
RIPK2 O43353 2/20 0.62
EPHX2 P34913 2/20 0.62
KIT P10721 2/20 0.62
BCR P11274 2/20 0.62
FGFR1 P11362 2/20 0.62
PDGFRA P16234 2/20 0.62
FLT1 P17948 2/20 0.62
EPHA1 P21709 2/20 0.62
TTK P33981 2/20 0.62
FLT4 P35916 2/20 0.62
FLT3 P36888 2/20 0.62
MAPKAPK2 P49137 2/20 0.62
CLK1 P49759 2/20 0.62

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
SCHEMBL1658928 0.91 RAF1 (0.69) ABL1RAF1BRAFKDRMAPK14
SCHEMBL1660279 0.91 RAF1 (0.66) ABL1RAF1BRAFKDRMAPK14
SCHEMBL14911164 0.91 ABL1 (0.73) ABL1RAF1BRAFKDRMAPK14
SCHEMBL1660353 0.91 RAF1 (0.63) ABL1RAF1BRAFKDRMAPK14
SCHEMBL19888733 0.90 ABL1 (0.65) ABL1RAF1BRAFKDRMAPK14
SCHEMBL10105554 0.89 ABL1 (0.67) ABL1RAF1BRAFKDRMAPK14
SCHEMBL1660178 0.89 RAF1 (0.68) ABL1RAF1BRAFKDRMAPK14
SCHEMBL1660265 0.88 ABL1 (0.57) ABL1RAF1BRAFKDRMAPK14
SCHEMBL1659070 0.88 MAPK14 (0.53) ABL1RAF1BRAFKDRMAPK14
SCHEMBL19888749 0.88 ABL1 (0.67) ABL1RAF1BRAFKDRMAPK14

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
WO-2011046991-A2 CERTAIN SUBSTITUTED UREAS AS MODULATORS OF KINASE ACTIVITY GILEAD CONNECTICUT, INC. (US) 2011-04-21 WO disclosed