SCHEMBL1661154

SCHEMBL1661154

CNC(=O)c1cc(Oc2ccc(NC(=O)Nc3cc(C(F)(F)F)ccc3OC(F)F)c(F)c2)ccn1

nearest known ligand 0.68

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAF1 P04049 6/20 0.68
BRAF P15056 9/20 0.61
KDR P35968 5/20 0.61
ABL1 P00519 3/20 0.61
DDR2 Q16832 2/20 0.61
RET P07949 2/20 0.61
EPHA2 P29317 2/20 0.61
MAPK14 Q16539 2/20 0.61
MAP3K20 Q9NYL2 2/20 0.61
RIPK2 O43353 2/20 0.61
EPHX2 P34913 2/20 0.61
ABCB11 O95342 1/20 0.61
NR3C1 P04150 1/20 0.61
HTR1A P08908 1/20 0.61
PDGFRB P09619 1/20 0.61
ADORA3 P0DMS8 1/20 0.61
KIT P10721 1/20 0.61
CHRM1 P11229 1/20 0.61
BCR P11274 1/20 0.61
FGFR1 P11362 1/20 0.61

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
SCHEMBL1660855 0.91 RAF1 (0.82) RAF1BRAFKDRABL1DDR2
SCHEMBL1660319 0.90 BRAF (0.54) RAF1BRAFKDRABL1DDR2
SCHEMBL1660403 0.89 BRAF (0.68) RAF1BRAFKDRABL1DDR2
SCHEMBL1660265 0.88 ABL1 (0.57) RAF1BRAFKDRABL1DDR2
SCHEMBL1659561 0.88 RAF1 (0.61) RAF1BRAFKDRABL1DDR2
SCHEMBL1659057 0.86 MAPK14 (0.75) RAF1BRAFKDRABL1DDR2
SCHEMBL18191221 0.85 RAF1 (0.76) RAF1BRAFKDRABL1DDR2
SCHEMBL14911164 0.83 ABL1 (0.73) RAF1BRAFKDRABL1DDR2
SCHEMBL2332335 0.83 RAF1 (0.61) RAF1BRAFKDRABL1DDR2
SCHEMBL19878527 0.82 KDR (0.81) RAF1BRAFKDRABL1DDR2

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