SCHEMBL28514560

SCHEMBL28514560

Cc1ccc(C)c(Nc2cc(NC(=O)Nc3c(Cl)cccc3Cl)ncn2)c1

nearest known ligand 0.64

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
EGFR P00533 4/20 0.64
FGFR1 P11362 4/20 0.64
SRC P12931 2/20 0.52
ABL1 P00519 1/20 0.52
PDGFRB P09619 1/20 0.52
KIT P10721 1/20 0.52
BRAF P15056 1/20 0.52
KDR P35968 1/20 0.52
EPHB4 P54760 1/20 0.52
TEK Q02763 1/20 0.52
NPSR1 Q6W5P4 1/20 0.44
LCK P06239 8/20 0.42
FYN P06241 1/20 0.41
RAB9A P51151 2/20 0.41
GBA1 P04062 1/20 0.41
MAPT P10636 1/20 0.41
S1PR1 P21453 1/20 0.41
NPC1 O15118 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.41

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
SCHEMBL28515327 0.78 EGFR (1.00) EGFRFGFR1SRCABL1PDGFRB
SCHEMBL379004 0.77 EGFR (0.69) EGFRFGFR1SRCABL1PDGFRB
SCHEMBL28260312 0.77 EGFR (1.00) EGFRFGFR1SRCABL1PDGFRB
SCHEMBL377191 0.76 EGFR (0.61) EGFRFGFR1SRCABL1PDGFRB
SCHEMBL28515074 0.75 EGFR (0.71) EGFRFGFR1SRCABL1PDGFRB
SCHEMBL374328 0.75 EGFR (0.74) EGFRFGFR1SRCABL1PDGFRB
SCHEMBL28503748 0.75 EGFR (0.66) EGFRFGFR1SRCABL1PDGFRB
SCHEMBL28261624 0.75 EGFR (1.00) EGFRFGFR1SRCABL1PDGFRB
SCHEMBL374014 0.75 EGFR (0.66) EGFRFGFR1SRCABL1PDGFRB
SCHEMBL373388 0.74 EGFR (0.54) EGFRFGFR1SRCABL1PDGFRB

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
CN-109053593-B 1- (2, 6-chlorphenyl) -3- (substituted pyrimidine-4-yl) urea compound and preparation and application thereof 温州医科大学 2020-12-04 CN disclosed