SCHEMBL5264451

SCHEMBL5264451

COc1cc2[nH]c(Cl)nc(=O)c2c(OC)c1OC

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ GRIN2D O15399 4/20 0.43
▸ GRIN3B O60391 4/20 0.43
▸ GRIN1 Q05586 4/20 0.43
▸ GRIN2A Q12879 4/20 0.43
▸ GRIN2B Q13224 4/20 0.43
▸ GRIN2C Q14957 4/20 0.43
▸ GRIN3A Q8TCU5 4/20 0.43
▸ PDE3B Q13370 2/20 0.43
▸ PDE3A Q14432 2/20 0.43
▸ SMN1; SMN2 Q16637 2/20 0.42
▸ NPC1 O15118 1/20 0.42
▸ ALDH1A1 P00352 5/20 0.38
▸ CYP19A1 P11511 2/20 0.38
▸ NQO2 P16083 2/20 0.38
▸ KDM4E B2RXH2 2/20 0.37
▸ HPGD P15428 2/20 0.37
▸ KDR P35968 1/20 0.37
▸ LMNA P02545 1/20 0.37
▸ AURKA O14965 1/20 0.36
▸ ABCB1 P08183 1/20 0.36

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
SCHEMBL5261238 0.88 PDE3B (0.40) GRIN2DGRIN3BGRIN1GRIN2AGRIN2B
SCHEMBL5259625 0.80 PDE3B (0.39) GRIN2DGRIN3BGRIN1GRIN2AGRIN2B
SCHEMBL5265193 0.79 PDE3B (0.39) GRIN2DGRIN3BGRIN1GRIN2AGRIN2B
SCHEMBL5264455 0.77 PDE3B (0.45) GRIN2DGRIN3BGRIN1GRIN2AGRIN2B
SCHEMBL5620844 0.76 ALDH1A1 (0.53) GRIN2DGRIN3BGRIN1GRIN2AGRIN2B
SCHEMBL10744511 0.75 PDE3B (0.46) GRIN2DGRIN3BGRIN1GRIN2AGRIN2B
SCHEMBL5621447 0.74 TDP1 (0.35) SMN1; SMN2NPC1ALDH1A1KDM4EHPGD
SCHEMBL6377711 0.74 ALDH1A1 (0.39) SMN1; SMN2NPC1ALDH1A1HPGDKDR
Hydrochloric Acid SCHEMBL5263673 0.73 ALDH1A1 (0.38) SMN1; SMN2NPC1ALDH1A1HPGDKDR
SCHEMBL1805778 0.73 BRD4 (0.43) GRIN2DGRIN3BGRIN1GRIN2AGRIN2B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20070265446-A1 Arylamine-substituted quinazolinone compounds useful as alpha 1A/B adrenergic receptor antagonists CONNOLLY TERRENCE J 2007-11-15 — — US disclosed
US-7244738-B2 Arylamine-substituted quinazolinone compounds useful as alpha 1A/B adrenergic receptor antagonists ROCHE PALO ALTO LLC (US) 2007-07-17 — — US disclosed
EP-1644343-B1 5-SUBSTITUTED QUINAZOLINONE DERIVATIVES HOFFMANN LA ROCHE (CH) 2007-07-04 — — EP disclosed
CN-1845924-A Arylamine-substituted quinazolinone compounds HOFFMANN LA ROCHE (CH) 2006-10-11 — — CN disclosed
EP-1644343-A1 5-SUBSTITUTED QUINAZOLINONE DERIVATIVES F. HOFFMANN-LA ROCHE AG (CH) 2006-04-12 — — EP disclosed
EP-1644369-A2 ARYLAMINE-SUBSTITUTED QUINAZOLINONE COMPOUNDS F. HOFFMANN-LA ROCHE AG (CH) 2006-04-12 — — EP disclosed
US-20050124607-A1 5-Substituted quinazolinone compounds useful as alpha 1A/B adrenergic receptor antagonists ROCHE PALO ALTO LLC 2005-06-09 — — US disclosed
US-20050038016-A1 Arylamine-substituted quinazolinone compounds useful as alpha 1A/B adrenergic receptor antagonists ROCHE PALO ALTO LLC 2005-02-17 — — US disclosed
WO-2005005395-A2 ARYLAMINE-SUBSTITUTED QUINAZOLINONE COMPOUNDS F. HOFFMANN-LA ROCHE AG (CH) 2005-01-20 — — WO disclosed
WO-2005005397-A1 5-SUBSTITUTED QUINAZOLINONE DERIVATIVES F. HOFFMANN-LA ROCHE AG (CH) 2005-01-20 — — 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 (3 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-20070265446-A1 Arylamine-substituted quinazolinone compounds useful as alpha 1A/B adrenergic receptor antagonists ADRB1, ADRA1A, ADRA1B GRIN2D 1322/4885GRIN3B 921/4885GRIN1 643/4885
US-20050124607-A1 5-Substituted quinazolinone compounds useful as alpha 1A/B adrenergic receptor antagonists ADRB1, ADRA1B, ADRB2 GRIN2D 1450/4885GRIN3B 767/4885GRIN1 1240/4885
US-20050038016-A1 Arylamine-substituted quinazolinone compounds useful as alpha 1A/B adrenergic receptor antagonists ADRB1, ADRA1A, ADRA1B GRIN2D 1322/4885GRIN3B 921/4885GRIN1 643/4885

“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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