SCHEMBL14044883

SCHEMBL14044883

CNC(=N)Nc1cc(NC(=O)c2sccc2NCc2ccnc3ccccc23)ccc1C

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDR P35968 6/20 0.60
KIT P10721 2/20 0.60
RAF1 P04049 2/20 0.60
LCK P06239 1/20 0.60
RET P07949 1/20 0.60
CYP3A4 P08684 1/20 0.60
MAP3K20 Q9NYL2 1/20 0.60
RIPK3 Q9Y572 1/20 0.60
FLT1 P17948 4/20 0.45
BRAF P15056 2/20 0.44
MAPK8 P45983 1/20 0.40
MAPK9 P45984 1/20 0.40
MAPK10 P53779 1/20 0.40
MEN1 O00255 5/20 0.36
KMT2A Q03164 5/20 0.36
MAPT P10636 3/20 0.36
POLB P06746 2/20 0.36
F10 P00742 1/20 0.36
LMNA P02545 2/20 0.36
HTT P42858 1/20 0.36

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
SCHEMBL14044899 0.90 KDR (0.69) KDRKITRAF1LCKRET
SCHEMBL14044850 0.90 KDR (0.61) KDRKITRAF1LCKRET
SCHEMBL5790468 0.90 KDR (0.63) KDRKITRAF1LCKRET
SCHEMBL4848368 0.86 KDR (0.56) KDRKITRAF1LCKRET
SCHEMBL4848373 0.86 KDR (0.56) KDRKITRAF1LCKRET
SCHEMBL633921 0.84 KDR (0.64) KDRKITRAF1LCKRET
SCHEMBL5790482 0.83 KDR (0.60) KDRKITRAF1LCKRET
SCHEMBL3745585 0.83 KDR (0.57) KDRKITRAF1LCKRET
SCHEMBL4846658 0.83 KDR (0.55) KDRKITRAF1LCKRET
SCHEMBL4846652 0.83 KDR (0.55) KDRKITRAF1LCKRET

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
US-7439256-B2 (Arylamidoaryl) cyanoguanidine compounds OSI PHARMACEUTICALS, INC. 2008-10-21 US disclosed