SCHEMBL6090880

SCHEMBL6090880

Cc1[nH]c(C=C2C(=O)NN=C2c2ncc[nH]2)c(C)c1C(=O)OCCN(C)C

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDGFRB P09619 5/20 0.42
FGFR1 P11362 4/20 0.42
ABL1 P00519 1/20 0.42
RET P07949 1/20 0.42
FLT3 P36888 1/20 0.42
ALK Q9UM73 1/20 0.42
KDR P35968 8/20 0.40
CHEK1 O14757 2/20 0.40
PRKAA1 Q13131 7/20 0.35
PRKAA2 P54646 6/20 0.35
CSF1R P07333 1/20 0.34
CHRM2 P08172 1/20 0.33
CHRM4 P08173 1/20 0.33
CHRM5 P08912 1/20 0.33
CHRM1 P11229 1/20 0.33
CHRM3 P20309 1/20 0.33
KDM4E B2RXH2 1/20 0.32
MEN1 O00255 1/20 0.32
MAPT P10636 1/20 0.32
KMT2A Q03164 1/20 0.32

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
SCHEMBL6090865 1.00 PDGFRB (0.42) PDGFRBFGFR1ABL1RETFLT3
SCHEMBL6089745 0.84 KDR (0.59) PDGFRBFGFR1ABL1RETFLT3
SCHEMBL6090260 0.84 KDR (0.56) PDGFRBFGFR1ABL1RETFLT3
SCHEMBL6090255 0.84 KDR (0.56) PDGFRBFGFR1ABL1RETFLT3
SCHEMBL6093136 0.81 PDGFRB (0.45) PDGFRBFGFR1ABL1RETFLT3
SCHEMBL6093126 0.81 PDGFRB (0.45) PDGFRBFGFR1ABL1RETFLT3
SCHEMBL6089149 0.81 PDGFRB (0.45) PDGFRBFGFR1ABL1RETFLT3
SCHEMBL6089154 0.81 PDGFRB (0.45) PDGFRBFGFR1ABL1RETFLT3
SCHEMBL6088027 0.81 PDGFRB (0.48) PDGFRBFGFR1ABL1RETFLT3
SCHEMBL6088031 0.81 PDGFRB (0.48) PDGFRBFGFR1ABL1RETFLT3

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