SCHEMBL27495149

SCHEMBL27495149

O=C(Nc1nnc(Cc2ccncc2)c2ccccc12)c1cc(Cl)cc(C(F)(F)F)c1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KDR P35968 15/20 0.56
▸ FLT1 P17948 13/20 0.56
▸ PDGFRB P09619 11/20 0.52
▸ KIT P10721 10/20 0.52
▸ CSF1R P07333 2/20 0.51
▸ FLT4 P35916 2/20 0.51
▸ DDR1 Q08345 3/20 0.50
▸ CIT O14578 1/20 0.50
▸ EGFR P00533 1/20 0.50
▸ HLA-A P04439 1/20 0.50
▸ RET P07949 1/20 0.50
▸ PDGFRA P16234 1/20 0.50
▸ RPS6KB1 P23443 1/20 0.50
▸ FRK P42685 1/20 0.50
▸ CDK8 P49336 1/20 0.50
▸ STK3 Q13188 1/20 0.50
▸ PTK6 Q13882 1/20 0.50
▸ MAP3K19 Q56UN5 1/20 0.50
▸ CDK19 Q9BWU1 1/20 0.50
▸ MAP3K20 Q9NYL2 1/20 0.50

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
SCHEMBL4818044 0.81 KDR (0.79) KDRFLT1PDGFRBKITCSF1R
SCHEMBL28752805 0.80 FLT1 (0.64) KDRFLT1PDGFRBKITCSF1R
SCHEMBL27625198 0.77 KDR (0.57) KDRFLT1PDGFRBKITCSF1R
SCHEMBL27625380 0.77 KDR (0.65) KDRFLT1PDGFRBKITCSF1R
SCHEMBL28021680 0.76 FLT1 (0.54) KDRFLT1PDGFRBKITCSF1R
SCHEMBL906268 0.72 KDR (0.80) KDRFLT1PDGFRBKITCSF1R
SCHEMBL27511538 0.70 FLT1 (0.60) KDRFLT1PDGFRBKITCSF1R
SCHEMBL28073018 0.69 MAPT (0.64) KDRFLT1PDGFRBKITCSF1R
SCHEMBL20431327 0.69 KDR (0.64) KDRFLT1PDGFRBKITCSF1R
Vatalanib SCHEMBL6605579 0.69 KDR (0.88) KDRFLT1PDGFRBKITCSF1R

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-1221262-C Phthalazine derivatives for the treatment of inflammatory diseases NOVARTIS AG (CH) 2005-10-05 — — CN disclosed
CN-1660840-A Phthalazine derivatives for treating inflammatory diseases NOVARTIS AG (CH) 2005-08-31 — — CN disclosed
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