SCHEMBL195792

SCHEMBL195792

[O-][n+]1cc2ccccc2[n+]([O-])c1

nearest known ligand 0.43

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
ATM Q13315 1/20 0.43
BCL2 P10415 1/20 0.32
NPC1 O15118 1/20 0.32
RAB9A P51151 1/20 0.32
CYP2A6 P11509 1/20 0.30
ALOX12 P18054 1/20 0.30

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
Hydrochloric Acid SCHEMBL27585728 0.98 ATM (0.41) ATMBCL2NPC1RAB9A
SCHEMBL5894589 0.71
SCHEMBL9531 0.69 ATM (0.48) ATM
SCHEMBL5894528 0.67 KDM4E (0.35) NPC1RAB9A
SCHEMBL5894144 0.67 MMP2 (0.35) NPC1RAB9AALOX12
SCHEMBL28126562 0.67 ATM (0.46) ATM
Hydrochloric Acid SCHEMBL7370284 0.67 BCHE (0.50)
Water SCHEMBL5786021 0.67 ATM (0.46) ATM
SCHEMBL27684621 0.67 ATM (0.46) ATM
Fluoride SCHEMBL27608168 0.67 ATM (0.46) ATM

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 42 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2742042-A1 QUINAZOLINE-2,4-DIONE DERIVATIVES Actelion Pharmaceuticals Ltd. (CH) 2014-06-18 EP claimed
WO-2013021363-A1 QUINAZOLINE-2,4-DIONE DERIVATIVES ACTELION PHARMACEUTICALS LTD (CH) 2013-02-14 WO claimed
US-20060156485-A1 Keratin dyeing compounds, keratin dyeing compositions containing them, and use thereof THE PROCTER & GAMBLE COMPANY (US) 2006-07-20 US claimed
EP-2742042-A1 QUINAZOLINE-2,4-DIONE DERIVATIVES Actelion Pharmaceuticals Ltd. (CH) 2014-06-18 EP disclosed
WO-2013021363-A1 QUINAZOLINE-2,4-DIONE DERIVATIVES ACTELION PHARMACEUTICALS LTD (CH) 2013-02-14 WO disclosed
US-20120129876-A1 [4-(6-FLUORO-7-METHYLAMINO-2,4-DIOXO-1,4-DIHYDRO-2H-QUINAZOLIN-3-YL)-PHENYL]-5-CHLORO-THIOPHEN-2-YL-SULFONYLUREA SALTS, FORMS AND METHODS RELATED THERETO PORTOLA PHARMACEUTICALS, INC. (US) 2012-05-24 US disclosed
US-20120088736-A1 [4-(6-HALO-7-Substituted-2,4-DIOXO-1,4-DIHYDRO-2H-QUINAZOLIN-3-YL)-PHENYL]-5-CHLORO-THIOPHEN-2-YL-SULFONYLUREAS and Forms and Methods Related Thereto PORTOLA PHARMACEUTICALS, INC. (US) 2012-04-12 US disclosed
EP-2428514-A1 [4-(6-halo-7-substituted-2,4-dioxo-1,4-dihydro-2h-quinazolin-3-yl)-phenyl]-5-chloro-thiophen-2-yl-sulfonylureas and forms and methods related thereto Portola Pharmaceuticals, Inc. (US) 2012-03-14 EP disclosed
US-20120009172-A1 INTRAVENOUS AND ORAL DOSING OF A DIRECT-ACTING AND REVERSIBLE P2Y12 INHIBITOR PORTOLA PHARMACEUTICALS, INC. (US) 2012-01-12 US disclosed
EP-1951254-B1 [4-(6-HALO-7-SUBSTITUTED-2,4-DIOXO-1,4-DIHYDRO-2H-QUINAZOLIN-3-YL)-PHENYL]-5-CHLORO-THIOPHEN-2-YL-SULFONYLUREAS AND FORMS AND METHODS RELATED THERETO PORTOLA PHARM INC (US) 2012-01-04 EP disclosed
US-8058284-B2 [4-(6-halo-7-substituted-2,4-dioxo-1,4-dihydro-2H-quinazolin-3-yl)-phenyl]-5-chloro-thiophen-2-yl-sulfonylureas and forms and methods related thereto PORTOLA PHARMACEUTICALS, INC. (US) 2011-11-15 US disclosed
US-4371685-A Radiation-reactive precursor stages of highly heat-resistant polymers SIEMENS AKTIENGESELLSCHAFT (DE) 1983-02-01 US disclosed
US-4366230-A Method for the preparation of highly heat-resistant relief structures and the use thereof SIEMENS AKTIENGESELLSCHAFT (DE) 1982-12-28 US disclosed
US-4332883-A POLYAMIDE HAVING HYDROXYL GROUPS MODIFIED WITH GLYCIDYL ACRYLATE OR METHACRYLATE SIEMENS AKTIENGESELLSCHAFT (DE) 1982-06-01 US disclosed
US-4332882-A POLYIMIDAZOLES AND POLYIMIDAZOPYRROLONES SIEMENS AKTIENGESELLSCHAFT (DE) 1982-06-01 US disclosed
US-4311785-A Method for the preparation of highly heat-resistant relief structures and the use thereof SIEMENS AKTIENGESELLSCHAFT (DE) 1982-01-19 US disclosed
US-4258187-A REACTING 2-AMINO-BENZOPHENONE DERIVATIVES WITH A HYDROXYLAMINE SALT E. I. DU PONT DE NEMOURS AND COMPANY (US) 1981-03-24 US disclosed
US-4160092-A FOR 3-FLUOROBENZODIAZEPINES USEFUL AS SEDATIVES, TRANQUILIZERS AND MXUCLE RELAXANTS E. I. DU PONT DE NEMOURS AND COMPANY (US) 1979-07-03 US disclosed
EP-0000149-A1 Process for preparing quinazolinone oxides E.I. DU PONT DE NEMOURS AND COMPANY (US) 1979-01-10 EP disclosed
EP-0000148-A1 Quinazolinone oxides and process for their preparation E.I. DU PONT DE NEMOURS AND COMPANY (US) 1979-01-10 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 (4 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-20120009172-A1 INTRAVENOUS AND ORAL DOSING OF A DIRECT-ACTING AND REVERSIBLE P2Y12 INHIBITOR P2RY12, P2RY11, P2RY13 ATM 2244/4885BCL2 4660/4885NPC1 3834/4885
US-20120088736-A1 [4-(6-HALO-7-Substituted-2,4-DIOXO-1,4-DIHYDRO-2H-QUINAZOLIN-3-YL)-PHENYL]-5-CHLORO-THIOPHEN-2-YL-SULFONYLUREAS and Forms and Methods Related Thereto P2RX7, P2RY1, P2RY6 ATM 4059/4885BCL2 4250/4885NPC1 1398/4885
US-20060156485-A1 Keratin dyeing compounds, keratin dyeing compositions containing them, and use thereof KRT18, TUBB6, DNMT1 ATM 3130/4885BCL2 1827/4885NPC1 4475/4885
US-20120129876-A1 [4-(6-FLUORO-7-METHYLAMINO-2,4-DIOXO-1,4-DIHYDRO-2H-QUINAZOLIN-3-YL)-PHENYL]-5-CHLORO-THIOPHEN-2-YL-SULFONYLUREA SALTS, FORMS AND METHODS RELATED THERETO P2RY1, P2RY6, P2RY4 ATM 4340/4885BCL2 4088/4885NPC1 1960/4885

“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.