SCHEMBL4593685

SCHEMBL4593685

CC(=O)Nc1nc(Nc2ccccc2)c2ccccc2n1

nearest known ligand 0.67

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPY5R Q15761 7/20 0.67
ACHE P22303 3/20 0.65
APP P05067 2/20 0.65
ADORA3 P0DMS8 1/20 0.64
KDM4E B2RXH2 4/20 0.64
MAPT P10636 4/20 0.64
KMT2A Q03164 4/20 0.64
MEN1 O00255 3/20 0.64
ALDH1A1 P00352 2/20 0.64
ABCG2 Q9UNQ0 2/20 0.60
MAPK1 P28482 1/20 0.60
SMN1; SMN2 Q16637 2/20 0.57
KDM1A O60341 2/20 0.57
MITF O75030 1/20 0.57
LMNA P02545 1/20 0.57
POLB P06746 1/20 0.57
RAD52 P43351 1/20 0.57
RECQL P46063 1/20 0.57
NPSR1 Q6W5P4 1/20 0.57
L3MBTL1 Q9Y468 1/20 0.57

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
SCHEMBL2591063 0.81 NPY5R (1.00) NPY5RKMT2AMEN1ABCG2MAPK1
SCHEMBL2257787 0.80 NPY5R (0.77) NPY5RKDM4EKMT2AMEN1ALDH1A1
Hydrochloric Acid SCHEMBL6039677 0.79 NPY5R (0.96) NPY5RKDM4EMAPTKMT2AMEN1
SCHEMBL31060818 0.78 ADORA3 (1.00) ACHEAPPADORA3KDM4EMAPT
SCHEMBL28212751 0.77 ADORA3 (0.61) ACHEAPPADORA3KDM4EMAPT
SCHEMBL8890470 0.76 NPY5R (0.70) NPY5RKMT2AMEN1ABCG2KDM1A
SCHEMBL3934069 0.76 MKNK2 (0.49) NPY5RACHEAPPADORA3KDM4E
SCHEMBL8890945 0.76 NPY5R (1.00) NPY5RKDM4EMAPTKMT2AMEN1
SCHEMBL8890734 0.76 NPY5R (0.81) NPY5RMAPTKMT2AMEN1ALDH1A1
Hydrochloric Acid SCHEMBL8900357 0.75 NPY5R (0.97) NPY5RKDM4EMAPTKMT2AALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-108125959-B Application of dimethoxy phenylamino acetamido quinazoline compound in preparation of drugs for treating leukemia 浙江工业大学 2019-12-31 CN claimed
CN-108125959-B Application of dimethoxy phenylamino acetamido quinazoline compound in preparation of drugs for treating leukemia 浙江工业大学 2019-12-31 CN disclosed
CN-108125959-B Application of dimethoxy phenylamino acetamido quinazoline compound in preparation of drugs for treating leukemia 浙江工业大学 2019-12-31 CN disclosed
CN-108125959-B Application of dimethoxy phenylamino acetamido quinazoline compound in preparation of drugs for treating leukemia 浙江工业大学 2019-12-31 CN disclosed
EP-1594504-A4 NOVEL IRREVERSIBLE INHIBITORS OF EPIDERMAL GROWTH FACTOR RECEPTOR TYROSINE KINASE AND USES THEREOF FOR THERAPY AND DIAGNOSIS T K SIGNAL LTD (IL) 2008-12-17 EP disclosed
US-20060025430-A1 Novel irreversible inhibitors of epidermal growth factor receptor tyrosine kinase and uses thereof for therapy and diagnosis T.K. SIGNAL LTD. (IL) 2006-02-02 US disclosed
EP-1594504-A2 NOVEL IRREVERSIBLE INHIBITORS OF EPIDERMAL GROWTH FACTOR RECEPTOR TYROSINE KINASE AND USES THEREOF FOR THERAPY AND DIAGNOSIS T.K. Signal Ltd. (IL) 2005-11-16 EP disclosed
WO-2004064718-A2 IRREVERSIBLE INHIBITORS OF EGF RECEPTOR TYROSINE KINASES AND USES THEREOF T.K. SIGNAL LTD. (IL) 2004-08-05 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-20060025430-A1 Novel irreversible inhibitors of epidermal growth factor receptor tyrosine kinase and uses thereof for therapy and diagnosis EGFR, ERBB2, ERBB3 NPY5R 2541/4885ACHE 2924/4885APP 4229/4885

“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.