SCHEMBL6364161

SCHEMBL6364161

Nc1cc2cncnc2cn1

nearest known ligand 0.57

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
EGFR P00533 11/20 0.57
PDPK1 O15530 1/20 0.43
PIK3CD O00329 1/20 0.40
PIK3CA P42336 1/20 0.40
NOS3 P29474 2/20 0.37
NOS1 P29475 2/20 0.37
NOS2 P35228 2/20 0.37
PIK3CB P42338 1/20 0.36
FGFR1 P11362 1/20 0.36
SRC P12931 1/20 0.36
CSNK1D P48730 1/20 0.34
CSNK1E P49674 1/20 0.34
CLK1 P49759 1/20 0.34
DYRK1A Q13627 1/20 0.34
FGFR4 P22455 1/20 0.34
HSP90AA1 P07900 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
SCHEMBL8874014 0.76 EGFR (0.58) EGFRPIK3CDPIK3CACSNK1DCSNK1E
SCHEMBL30466554 0.76 EGFR (0.48) EGFRPIK3CDPIK3CAFGFR4
SCHEMBL7222157 0.76 EGFR (0.59) EGFRPIK3CDPIK3CACSNK1DCSNK1E
SCHEMBL6765023 0.76 EGFR (0.48) EGFRPIK3CDPIK3CAFGFR4
SCHEMBL7920056 0.74 EGFR (0.47) EGFRPIK3CDPIK3CAFGFR4
SCHEMBL27918893 0.74 EGFR (0.52) EGFRPIK3CDPIK3CACSNK1DCSNK1E
SCHEMBL921632 0.72 EGFR (1.00) EGFRPIK3CDPIK3CAFGFR4HSP90AA1
SCHEMBL29504195 0.72 EGFR (1.00) EGFRPIK3CDPIK3CAFGFR4HSP90AA1
SCHEMBL29925974 0.71 LCK (0.45) EGFRPIK3CDPIK3CA
SCHEMBL31352848 0.70 EGFR (0.52) EGFRPIK3CDPIK3CANOS2HSP90AA1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2005016925-A1 AZAQUINAZOLINE DERIVATIVES PFIZER LIMITED (GB) 2005-02-24 WO disclosed
WO-2005016925-A1 AZAQUINAZOLINE DERIVATIVES PFIZER LIMITED (GB) 2005-02-24 WO disclosed
US-20050038047-A1 Azaquinazoline derivatives EDWARDS PAUL JOHN (GB) 2005-02-17 US disclosed
US-20050038047-A1 Azaquinazoline derivatives EDWARDS PAUL JOHN (GB) 2005-02-17 US 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-20050038047-A1 Azaquinazoline derivatives AZI2, P2RX5, P2RX7 EGFR 4865/4885PDPK1 1157/4885PIK3CD 754/4885

“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.