SCHEMBL7280956

SCHEMBL7280956

O=C(O)c1cccc(Nc2nc(-c3ccncc3)nc3ccccc23)c1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
ABCG2 Q9UNQ0 12/20 1.00
MEN1 O00255 3/20 0.84
KMT2A Q03164 3/20 0.84
ABCB1 P08183 4/20 0.80
L3MBTL1 Q9Y468 1/20 0.76
ALDH1A1 P00352 2/20 0.72
POLB P06746 2/20 0.72
HPGD P15428 2/20 0.72
LMNA P02545 1/20 0.72
GSK3A P49840 1/20 0.72
GSK3B P49841 1/20 0.72
KDM4E B2RXH2 2/20 0.72
PDE5A O76074 2/20 0.72
SMN1; SMN2 Q16637 1/20 0.72

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
SCHEMBL13945461 0.93 MEN1 (0.97) ABCG2MEN1KMT2AABCB1L3MBTL1
SCHEMBL22201624 0.91 ABCG2 (0.83) ABCG2MEN1KMT2AABCB1L3MBTL1
SCHEMBL5526966 0.87 MEN1 (0.82) ABCG2MEN1KMT2AABCB1L3MBTL1
SCHEMBL13945465 0.87 MEN1 (0.82) ABCG2MEN1KMT2AABCB1L3MBTL1
SCHEMBL7434986 0.85 ALDH1A1 (1.00) ABCG2MEN1KMT2AABCB1ALDH1A1
SCHEMBL1083761 0.84 HPGD (1.00) ABCG2ABCB1ALDH1A1POLBHPGD
SCHEMBL1083768 0.83 KDM4E (1.00) ABCG2ABCB1ALDH1A1POLBHPGD
SCHEMBL22201579 0.83 ABCG2 (0.85) ABCG2MEN1KMT2AABCB1ALDH1A1
SCHEMBL1083771 0.83 MEN1 (0.98) ABCG2MEN1KMT2AABCB1L3MBTL1
SCHEMBL15977127 0.83 ABCG2 (0.84) ABCG2MEN1KMT2AABCB1ALDH1A1

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
EP-0579496-B1 4-Aminoquinazoline derivatives, and their use as medicine ONO PHARMACEUTICAL CO (JP) 2001-11-14 EP claimed
EP-0579496-A1 4-Aminoquinazoline derivatives, and their use as medicine ONO PHARMACEUTICAL CO., LTD. (JP) 1994-01-19 EP claimed
US-20020025968-A1 Method for inhibiting neoplastic cells and related conditions by exposure to 4-aminoquinazoline derivatives OSI PHARMACEUTICALS, INC. 2002-02-28 US disclosed
EP-0579496-B1 4-Aminoquinazoline derivatives, and their use as medicine ONO PHARMACEUTICAL CO (JP) 2001-11-14 EP disclosed
WO-1999059584-A1 COMBINATION OF PHENTOLAMINE AND CYCLIC GMP PHOSPHODIESTERASE INHIBITORS FOR THE TREATMENT OF SEXUAL DYSFUNCTION SCHERING CORPORATION (US) 1999-11-25 WO disclosed
US-5439895-A Cardiovascular disorders; inhibitor of thromboxane A2 synthetase and cyclic guanosine 3',5'-monophosphate ONO PHARMACEUTICAL CO., LTD. (JP) 1995-08-08 US disclosed
US-5436233-A Nervous system disorders ONO PHARMACEUTICAL CO., LTD. (JP) 1995-07-25 US disclosed
EP-0579496-A1 4-Aminoquinazoline derivatives, and their use as medicine ONO PHARMACEUTICAL CO., LTD. (JP) 1994-01-19 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-20020025968-A1 Method for inhibiting neoplastic cells and related conditions by exposure to 4-aminoquinazoline derivatives VHL, MCL1, NFATC1 ABCG2 3440/4885MEN1 893/4885KMT2A 767/4885

“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.