SCHEMBL5437112

SCHEMBL5437112

COc1cc2c(Cl)ncnc2cc1OCCC1CCN(C(=O)O)CC1

nearest known ligand 0.56

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
ENPP1 P22413 7/20 0.56
KDR P35968 5/20 0.51
FLT1 P17948 3/20 0.51
EGFR P00533 2/20 0.51
FGFR1 P11362 2/20 0.51
FLT4 P35916 2/20 0.51
EPHA2 P29317 3/20 0.49
EPHB4 P54760 3/20 0.49
ACHE P22303 1/20 0.46
BACE1 P56817 1/20 0.46
MAPK1 P28482 1/20 0.46
ERBB2 P04626 1/20 0.45
MAPK7 Q13164 3/20 0.44
PDGFRB P09619 2/20 0.44
DRD2 P14416 1/20 0.44
DRD4 P21917 1/20 0.44

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
SCHEMBL5430434 0.90 ENPP1 (0.54) ENPP1KDRFLT1EGFRFGFR1
SCHEMBL5214519 0.89 ENPP1 (0.52) ENPP1KDRFLT1EGFRFGFR1
SCHEMBL4377475 0.86 EGFR (0.64) ENPP1KDRFLT1EGFRFGFR1
SCHEMBL6415927 0.86 ENPP1 (0.54) ENPP1KDRFLT1EGFRFGFR1
SCHEMBL3129523 0.83 EGFR (0.56) ENPP1EGFREPHB4ERBB2
SCHEMBL4087511 0.83 EGFR (0.56) ENPP1EGFREPHB4ERBB2
SCHEMBL3928120 0.83 ENPP1 (0.57) ENPP1KDRFLT1EGFRFGFR1
SCHEMBL5438862 0.82 ENPP1 (0.52) ENPP1KDRFLT1EGFRFGFR1
SCHEMBL5433323 0.82 ENPP1 (0.52) ENPP1KDRFLT1EGFRFGFR1
SCHEMBL17179600 0.80 EPHA2 (0.52) ENPP1KDRFLT1EGFRFGFR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20070027145-A1 Quinazoline derivatives as inhibitors of vegf receptor tyrosine kinases ASTRAZENCA (SE) 2007-02-01 US disclosed
EP-1653965-A1 QUINAZOLINE DERIVATIVES AS INHIBITORS OF VEGF RECEPTOR TYROSINE KINASES Astrazeneca AB (SE) 2006-05-10 EP disclosed
WO-2005013998-A1 QUINAZOLINE DERIVATIVES AS INHIBITORS OF VEGF RECEPTOR TYROSINE KINASES ASTRAZENECA AB (SE) 2005-02-17 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20070027145-A1 Quinazoline derivatives as inhibitors of vegf receptor tyrosine kinases FLT4, FLT1, VEGFA ENPP1 2940/4885KDR 4/4885FLT1 2/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.