SCHEMBL15775356

SCHEMBL15775356

O=c1[nH]c(-c2ccc([N+](=O)[O-])cc2)nc2ccccc12

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TNKS O95271 14/20 1.00
TNKS2 Q9H2K2 13/20 1.00
GUSB P08236 7/20 1.00
PARP2 Q9UGN5 3/20 1.00
NLRP3 Q96P20 1/20 1.00
PARP1 P09874 7/20 0.69
MMP2 P08253 1/20 0.68
MMP9 P14780 1/20 0.68
MMP8 P22894 1/20 0.68
CYP1A1 P04798 1/20 0.65
CYP1B1 Q16678 1/20 0.65
MAPT P10636 2/20 0.62
ALDH1A1 P00352 1/20 0.62
HPGD P15428 1/20 0.62
ALOX15 P16050 1/20 0.62
HSD17B10 Q99714 1/20 0.62
APOBEC3G Q9HC16 1/20 0.62
NPC1 O15118 2/20 0.60
RAB9A P51151 2/20 0.60
WNT3A P56704 1/20 0.60

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
SCHEMBL6885282 0.86 TNKS (0.93) TNKSTNKS2GUSBPARP2NLRP3
SCHEMBL30665826 0.86 TNKS (0.75) TNKSTNKS2GUSBPARP2NLRP3
SCHEMBL873782 0.85 GUSB (1.00) TNKSTNKS2GUSBPARP2NLRP3
SCHEMBL2991045 0.84 TNKS (0.73) TNKSTNKS2GUSBPARP2NLRP3
SCHEMBL6124189 0.83 TNKS (0.93) TNKSTNKS2GUSBPARP2NLRP3
SCHEMBL258433 0.83 TNKS (1.00) TNKSTNKS2GUSBPARP2NLRP3
SCHEMBL29592833 0.83 TNKS (1.00) TNKSTNKS2GUSBPARP2NLRP3
Hydrochloric Acid SCHEMBL31529601 0.81 TNKS (0.96) TNKSTNKS2GUSBPARP2NLRP3
SCHEMBL259520 0.81 TNKS (0.68) TNKSTNKS2GUSBPARP2NLRP3
SCHEMBL5010434 0.81 MMP2 (1.00) TNKSTNKS2GUSBPARP2NLRP3

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
CN-118359548-A Preparation method of benzodiazepine compound 重庆医科大学 2024-07-19 CN disclosed
CN-115010671-B One-step synthesis method of 2-substituted quinazolinone 江苏大学 2023-10-10 CN disclosed
CN-111777564-B Method for synthesizing quinazolinone compound by photocatalytic alcohol oxidation in aqueous phase 许昌学院 2023-07-14 CN disclosed
CN-111875549-B Method for synthesizing quinazolinone compound in aqueous phase through photocatalysis 许昌学院 2023-04-28 CN disclosed
CN-115010671-A One-step synthesis method of 2-substituted quinazolinone 江苏大学 2022-09-06 CN disclosed
CN-111777564-A Method for synthesizing quinazolinone compound through photocatalytic alcohol oxidation in aqueous phase 许昌学院 2020-10-16 CN disclosed
CN-104910079-A Method for preparing 4(3H)-quinazolinone derivative through toluene and derivative oxidation one-pot process UNIV TONGJI 2015-09-16 CN disclosed
CN-104557738-A Green synthesis method of 4(3H)-quinazolinone UNIV HUNAN 2015-04-29 CN disclosed
US-20140256754-A1 QUINAZOLINES AS B-GLUCURONIDASE NOVEL INHIBITORS CHOUDHARY MUHAMMAD IQBAL (PK) 2014-09-11 US disclosed
US-20140256754-A1 QUINAZOLINES AS B-GLUCURONIDASE NOVEL INHIBITORS CHOUDHARY MUHAMMAD IQBAL (PK) 2014-09-11 US disclosed
US-20140256754-A1 QUINAZOLINES AS B-GLUCURONIDASE NOVEL INHIBITORS CHOUDHARY MUHAMMAD IQBAL (PK) 2014-09-11 US disclosed
WO-2014087165-A1 TANKYRASE INHIBITORS UNIVERSITY OF BATH (GB) 2014-06-12 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-20140256754-A1 QUINAZOLINES AS B-GLUCURONIDASE NOVEL INHIBITORS GUSB, GBA3, GAA TNKS 1726/4885TNKS2 1674/4885GUSB 1/4885

“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.