SCHEMBL6089320

SCHEMBL6089320

Cc1[nH]c(/C=C2/C(=O)NN=C2c2cccnn2)c(C)c1CN1CCCCC1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDR P35968 10/20 0.45
CHEK1 O14757 3/20 0.45
FGFR1 P11362 4/20 0.39
PDGFRB P09619 3/20 0.39
KMT2A Q03164 4/20 0.36
HSD17B10 Q99714 3/20 0.36
MEN1 O00255 3/20 0.36
L3MBTL1 Q9Y468 1/20 0.35
AURKA O14965 2/20 0.34
RET P07949 2/20 0.34
FLT1 P17948 2/20 0.34
FLT3 P36888 2/20 0.34
MAP4K2 Q12851 2/20 0.34
STK3 Q13188 2/20 0.34
AURKB Q96GD4 2/20 0.34
GAK O14976 1/20 0.34
RPS6KA5 O75582 1/20 0.34
RPS6KA4 O75676 1/20 0.34
LATS1 O95835 1/20 0.34
CSNK2A2 P19784 1/20 0.34

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
SCHEMBL6089324 1.00 KDR (0.45) KDRCHEK1FGFR1PDGFRBKMT2A
SCHEMBL6089581 0.91 KDR (0.43) KDRCHEK1FGFR1PDGFRBHSD17B10
SCHEMBL6089572 0.91 KDR (0.43) KDRCHEK1FGFR1PDGFRBHSD17B10
SCHEMBL6099584 0.88 KDR (0.38) KDRCHEK1FGFR1PDGFRBKMT2A
SCHEMBL6099578 0.88 KDR (0.38) KDRCHEK1FGFR1PDGFRBKMT2A
SCHEMBL6088202 0.84 KDR (0.46) KDRCHEK1FGFR1PDGFRBKMT2A
SCHEMBL6088199 0.84 KDR (0.46) KDRCHEK1FGFR1PDGFRBKMT2A
SCHEMBL6090286 0.83 KDR (0.65) KDRCHEK1FGFR1PDGFRBKMT2A
SCHEMBL6090301 0.83 KDR (0.65) KDRCHEK1FGFR1PDGFRBKMT2A
SCHEMBL6091062 0.83 KDR (0.41) KDRCHEK1FGFR1PDGFRBKMT2A

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-7060822-B1 2-pyrazolin-5-ones ABBOTT GMBH & CO. KG (DE) 2006-06-13 US disclosed