SCHEMBL5581982

SCHEMBL5581982

CNc1ncc2c(-c3ccncc3)cc(Br)c(OC)c2n1

nearest known ligand 0.40

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
PTK2 Q05397 1/20 0.36
PDGFRB P09619 2/20 0.36
PDGFRA P16234 2/20 0.36
NQO2 P16083 1/20 0.35
EGFR P00533 2/20 0.34
CLK1 P49759 1/20 0.34
CLK2 P49760 1/20 0.34
CLK3 P49761 1/20 0.34
CDK5 Q00535 1/20 0.34
DYRK1A Q13627 1/20 0.34
CDK5R1 Q15078 1/20 0.34
CLK4 Q9HAZ1 1/20 0.34
DYRK1B Q9Y463 1/20 0.34
SLC2A1 P11166 1/20 0.34
NTRK1 P04629 4/20 0.33
TLR8 Q9NR97 1/20 0.33
GAK O14976 1/20 0.33
BRAF P15056 1/20 0.33

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
SCHEMBL5582141 0.89 NQO2 (0.41) PTK2NQO2EGFR
SCHEMBL5582011 0.87 PTK2 (0.47) PTK2EGFR
SCHEMBL5581980 0.87 NQO2 (0.36) NQO2EGFRBRAF
SCHEMBL5581933 0.83 CCR4 (0.33) NQO2EGFR
SCHEMBL5581881 0.83 KMO (0.37) PDGFRBPDGFRANQO2EGFRCLK1
SCHEMBL5581955 0.83 CYP17A1 (0.31) PTK2NQO2EGFR
SCHEMBL5582085 0.82 CSNK2A2 (0.38) NQO2EGFR
SCHEMBL5581776 0.82 FYN (0.39) PDGFRBPDGFRANQO2EGFRDYRK1A
SCHEMBL5582117 0.81 PTK2 (0.45) PTK2NQO2EGFR
SCHEMBL5585115 0.80 PIK3CD (0.39) NQO2EGFR

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
US-20070225308-A1 2-Amino Quinazoline Derivative KYOWA HAKKO KOGYO CO.,LTD. (JP) 2007-09-27 US disclosed
EP-1726584-A1 2-AMINOQUINAZOLINE DERIVATIVE KYOWA HAKKO KOGYO CO., LTD. (JP) 2006-11-29 EP 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-20070225308-A1 2-Amino Quinazoline Derivative AGTR2, ABL1, AGTR1 PTK2 4482/4885PDGFRB 2343/4885PDGFRA 2202/4885

“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.