SCHEMBL1885790

SCHEMBL1885790

CN(C)C(=O)C(Br)c1nc2cc(Cl)ccc2c(=O)[nH]1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ LMNA P02545 4/20 0.43
▸ POLB P06746 1/20 0.42
▸ TUBB4A P04350 1/20 0.42
▸ TUBB P07437 1/20 0.42
▸ TUBA3C P0DPH7 1/20 0.42
▸ TUBA1B P68363 1/20 0.42
▸ TUBA4A P68366 1/20 0.42
▸ TUBB4B P68371 1/20 0.42
▸ TUBB3 Q13509 1/20 0.42
▸ TUBB2A Q13885 1/20 0.42
▸ TUBB8 Q3ZCM7 1/20 0.42
▸ TUBA3E Q6PEY2 1/20 0.42
▸ TUBA1A Q71U36 1/20 0.42
▸ TUBA1C Q9BQE3 1/20 0.42
▸ TUBB6 Q9BUF5 1/20 0.42
▸ TUBB2B Q9BVA1 1/20 0.42
▸ TUBB1 Q9H4B7 1/20 0.42
▸ HPGD P15428 3/20 0.41
▸ MEN1 O00255 3/20 0.41
▸ MAPT P10636 3/20 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
SCHEMBL1891979 0.72 LMNA (0.56) LMNAPOLBTUBB4ATUBBTUBA3C
SCHEMBL1891976 0.71 KIF11 (0.56) POLBKDM4EALDH1A1TDP1
SCHEMBL1886419 0.71 BRD4 (0.39) LMNAPOLBHPGDGAAALDH1A1
SCHEMBL6027071 0.71 TUBB4A (0.50) POLBTUBB4ATUBBTUBA3CTUBA1B
SCHEMBL6670119 0.70 TYMS (0.63) LMNAPOLBTUBB4ATUBBTUBA3C
SCHEMBL3037555 0.69 TUBB4A (0.56) LMNAPOLBTUBB4ATUBBTUBA3C
SCHEMBL6025726 0.69 TUBB4A (0.52) POLBTUBB4ATUBBTUBA3CTUBA1B
SCHEMBL13343606 0.69 KDM4E (0.59) LMNAPOLBTUBB4ATUBBTUBA3C
SCHEMBL5649621 0.68 TRPA1 (0.42) LMNAPOLBTUBB4ATUBBTUBA3C
SCHEMBL5649627 0.68 TRPA1 (0.42) LMNAPOLBTUBB4ATUBBTUBA3C

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1689724-B1 QUINAZOLINONE COMPOUNDS AS ANTICANCER AGENTS NOVARTIS AG (CH) 2011-12-21 — — EP disclosed
EP-1689724-B1 QUINAZOLINONE COMPOUNDS AS ANTICANCER AGENTS NOVARTIS AG (CH) 2011-12-21 — — EP disclosed
US-20110190293-A1 Quinazolinone Compounds as Anticancer Agents CHIRON CORPORATION 2011-08-04 — — US disclosed
US-20110190293-A1 Quinazolinone Compounds as Anticancer Agents CHIRON CORPORATION 2011-08-04 — — US disclosed
US-20110190293-A1 Quinazolinone Compounds as Anticancer Agents CHIRON CORPORATION 2011-08-04 — — US disclosed
US-7939539-B2 Kinesin spindle protein (KSP) inhibitors; 2-substituted 4-(thio)oxo-3,4-dihydroquinazolines; use in combination with other anticancer agents NOVARTIS VACCINES AND DIAGNOSTICS, INC. (US) 2011-05-10 — — US disclosed
US-7939539-B2 Kinesin spindle protein (KSP) inhibitors; 2-substituted 4-(thio)oxo-3,4-dihydroquinazolines; use in combination with other anticancer agents NOVARTIS VACCINES AND DIAGNOSTICS, INC. (US) 2011-05-10 — — US disclosed
US-7939539-B2 Kinesin spindle protein (KSP) inhibitors; 2-substituted 4-(thio)oxo-3,4-dihydroquinazolines; use in combination with other anticancer agents NOVARTIS VACCINES AND DIAGNOSTICS, INC. (US) 2011-05-10 — — US disclosed
CN-1886384-A Quinazolinone compounds as anticancer agents CHIRON CORP (US) 2006-12-27 — — CN disclosed
EP-1689724-A1 QUINAZOLINONE COMPOUNDS AS ANTICANCER AGENTS Chiron Corporation (US) 2006-08-16 — — EP disclosed
US-20050209254-A1 Quinazolinone compounds as anticancer agents NOVARTIS VACCINES AND DIAGNOSTICS, INC. 2005-09-22 — — US disclosed
WO-2005051922-A1 QUINAZOLINONE COMPOUNDS AS ANTICANCER AGENTS CHIRON CORPORATION (US) 2005-06-09 — — 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 (2 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-20110190293-A1 Quinazolinone Compounds as Anticancer Agents TP53, NQO2, TOP1 LMNA 1850/4885POLB 597/4885TUBB4A 815/4885
US-20050209254-A1 Quinazolinone compounds as anticancer agents TP53, NQO2, TOP1 LMNA 1850/4885POLB 597/4885TUBB4A 815/4885

“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.

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