SCHEMBL6092643

SCHEMBL6092643

Cc1[nH]c(C=C2C(=O)NN=C2CCc2ccc(N)cc2)c(C)c1C(=O)OCCN(C)C

nearest known ligand 0.43

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
PDGFRB P09619 4/20 0.43
FGFR1 P11362 3/20 0.43
ABL1 P00519 1/20 0.43
RET P07949 1/20 0.43
FLT3 P36888 1/20 0.43
ALK Q9UM73 1/20 0.43
PHLPP2 Q6ZVD8 1/20 0.40
CHEK1 O14757 1/20 0.39
PRKAA1 Q13131 12/20 0.38
PRKAA2 P54646 11/20 0.38
KDR P35968 8/20 0.38
CSF1R P07333 1/20 0.33
EGFR P00533 1/20 0.32
PDGFRA P16234 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
SCHEMBL6089296 0.92 PDGFRB (0.44) PDGFRBFGFR1ABL1RETFLT3
SCHEMBL6089306 0.92 PDGFRB (0.44) PDGFRBFGFR1ABL1RETFLT3
SCHEMBL6092170 0.91 FGFR1 (0.48) PDGFRBFGFR1ABL1RETFLT3
SCHEMBL6092165 0.91 FGFR1 (0.48) PDGFRBFGFR1ABL1RETFLT3
SCHEMBL6088802 0.89 ABL1 (0.54) PDGFRBFGFR1ABL1RETFLT3
SCHEMBL6090814 0.84 KDR (0.55) PDGFRBFGFR1RETFLT3PRKAA1
SCHEMBL6088027 0.77 PDGFRB (0.48) PDGFRBFGFR1ABL1RETFLT3
SCHEMBL6088031 0.77 PDGFRB (0.48) PDGFRBFGFR1ABL1RETFLT3
SCHEMBL6091561 0.77 KDR (0.56) PDGFRBFGFR1RETFLT3PRKAA1
SCHEMBL6091575 0.77 KDR (0.56) PDGFRBFGFR1RETFLT3PRKAA1

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