SCHEMBL1660311

SCHEMBL1660311

Nc1n[nH]c2cccc(-c3ccc(NC(=O)Nc4cc(Cl)ccc4Cl)cc3)c12

nearest known ligand 0.78

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDR P35968 20/20 0.78
FLT3 P36888 15/20 0.78
KIT P10721 13/20 0.78
CSF1R P07333 7/20 0.70
FLT4 P35916 7/20 0.70
FLT1 P17948 6/20 0.70
PLK4 O00444 5/20 0.70
AURKA O14965 5/20 0.70
ROCK2 O75116 5/20 0.70
LYN P07948 5/20 0.70
MET P08581 5/20 0.70
PRKACA P17612 5/20 0.70
RPS6KB1 P23443 5/20 0.70
CSNK1D P48730 5/20 0.70
STK3 Q13188 5/20 0.70
ROCK1 Q13464 5/20 0.70
MARK2 Q7KZI7 5/20 0.70
AURKB Q96GD4 5/20 0.70
IRAK4 Q9NWZ3 5/20 0.70
LCK P06239 5/20 0.70

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
SCHEMBL1662335 0.91 KDR (0.81) KDRFLT3KITCSF1RFLT4
SCHEMBL1660289 0.90 KDR (0.75) KDRFLT3KITCSF1RFLT4
SCHEMBL1661033 0.88 KDR (0.71) KDRFLT3KITCSF1RFLT4
SCHEMBL421753 0.88 KDR (1.00) KDRFLT3KITCSF1RFLT4
SCHEMBL1660410 0.85 KDR (0.68) KDRFLT3KITCSF1RFLT4
SCHEMBL2750414 0.84 KDR (0.77) KDRFLT3KITCSF1RFLT4
SCHEMBL421644 0.83 KDR (1.00) KDRFLT3KITCSF1RFLT4
SCHEMBL424255 0.81 KDR (0.84) KDRFLT3KITCSF1RFLT4
SCHEMBL24232942 0.81 KDR (0.82) KDRFLT3KITCSF1RFLT4
SCHEMBL423838 0.81 KDR (1.00) KDRFLT3KITCSF1RFLT4

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