SCHEMBL15929508

SCHEMBL15929508

CNc1ncnc2cc(F)c([N+](=O)[O-])cc12

nearest known ligand 0.49

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
EGFR P00533 10/20 0.49
GALR2 O43603 1/20 0.46
LMNA P02545 1/20 0.46
POLB P06746 1/20 0.46
ABCG2 Q9UNQ0 3/20 0.44
FBP1 P09467 1/20 0.42
TYK2 P29597 1/20 0.41

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
SCHEMBL8932207 0.84 EGFR (0.50) EGFRGALR2LMNAPOLBABCG2
SCHEMBL8932196 0.83 EGFR (0.60) EGFRGALR2LMNAPOLBABCG2
SCHEMBL28622128 0.82 EGFR (0.41) EGFRABCG2FBP1
SCHEMBL17538470 0.81 MAPT (0.40) EGFRLMNAPOLBABCG2FBP1
SCHEMBL8932198 0.81 EGFR (0.64) EGFRGALR2LMNAPOLBABCG2
SCHEMBL26321 0.80 EGFR (0.64) EGFRABCG2FBP1
SCHEMBL159918 0.80 EGFR (0.52) EGFRABCG2FBP1
SCHEMBL19100039 0.80 S1PR2 (0.49) EGFRLMNAABCG2FBP1
SCHEMBL27410247 0.80 IRAK4 (0.52) EGFRLMNATYK2
SCHEMBL4579035 0.79 EGFR (0.51) EGFRPOLBABCG2FBP1

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-9187459-B2 Quinazoline-7-ether compounds and methods of use NEWGEN THERAPEUTICS, INC. (US) 2015-11-17 US disclosed
US-20140221406-A1 QUINAZOLINE-7-ETHER COMPOUNDS AND METHODS OF USE NEWGEN THERAPEUTICS, INC. (US) 2014-08-07 US disclosed
CN-103237801-A Quinoline or quinazoline derivatives having apoptosis-inducing activity on cells HANMI HOLDINGS CO LTD 2013-08-07 CN 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-20140221406-A1 QUINAZOLINE-7-ETHER COMPOUNDS AND METHODS OF USE ABL1, ERBB4, ERBB2 EGFR 5/4885GALR2 2563/4885LMNA 2534/4885

“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.