SCHEMBL1774535

SCHEMBL1774535

[B+3].[N-]=[N+]=[N-].[N-]=[N+]=[N-].[N-]=[N+]=[N-]

nearest known ligand 0.80

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
CA1 P00915 3/20 0.80
CA9 Q16790 2/20 0.67
ALDH1A1 P00352 1/20 0.67
TSHR P16473 1/20 0.67
TDP1 Q9NUW8 1/20 0.67
CA6 P23280 1/20 0.38
CA5A P35218 1/20 0.38
CA5B Q9Y2D0 1/20 0.38

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
SCHEMBL1512953 0.89
SCHEMBL9005288 0.89
SCHEMBL165 0.89
SCHEMBL447001 0.80
SCHEMBL461657 0.80
SCHEMBL10618143 0.80
SCHEMBL672625 0.80 CA1 (0.80) CA1CA9ALDH1A1TSHRTDP1
SCHEMBL11418636 0.80
SCHEMBL7885266 0.80 CA1 (0.80) CA1CA9ALDH1A1TSHRTDP1
SCHEMBL674048 0.80

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0759301-B1 Prevention and treatment of topical viral infections with perfluoropolyethers or compositions thereof MANN MORRIS A (US) 2001-05-30 EP claimed
EP-0670576-B1 Grazing incidence co-axial and confocal mirrors OSSERVATORIO ASTRONOMICO DI BR (IT) 1998-06-03 EP claimed
EP-0759301-A2 Prevention and treatment of topical viral infections with perfluoropolyethers or compositions thereof MORRIS A. MANN (US) 1997-02-26 EP claimed
US-5592338-A Grazing incidence co-axial and confocal OSSERVATORIO ASTRONOMICO DI BRERA (IT) 1997-01-07 US claimed
EP-0670576-A1 Grazing incidence co-axial and confocal mirrors OSSERVATORIO ASTRONOMICO DI BRERA (IT) 1995-09-06 EP claimed
CN-114736371-B Polyimide film with high heat conductivity and preparation method thereof 江阴市云达电子新材料有限公司 2023-05-09 CN disclosed
CN-115625938-A Boron nitride heat conduction gasket with high orientation degree and high out-of-plane heat conductivity, and preparation method and application thereof 中国科学院深圳先进技术研究院 2023-01-20 CN disclosed
CN-102215956-B Method for producing geometric catalyst moulded bodies BASF SE 2014-03-19 CN disclosed
US-8569528-B2 Process for the preparation of tetrazole derivatives from organo boron and organo aluminium azides NOVARTIS AG (CH) 2013-10-29 US disclosed
WO-2012148148-A9 NOVEL ZINC AZIDE COMPLEX AND A PROCESS FOR PREPARING TETRAZOLE DERIVATIVES USING THE SAME LG LIFE SCIENCES LTD. (KR) 2013-02-14 WO disclosed
US-20120330026-A1 PROCESS FOR THE PREPARATION OF TETRAZOLE DERIVATIVES FROM ORGANO BORON AND ORGANO ALUMINIUM AZIDES NOVARTIS AG (CH) 2012-12-27 US disclosed
WO-2012148148-A2 NOVEL ZINC AZIDE COMPLEX AND A PROCESS FOR PREPARING TETRAZOLE DERIVATIVES USING THE SAME LG LIFE SCIENCES LTD. (KR) 2012-11-01 WO disclosed
WO-2003061823-A1 A SUPPORTED METAL COMPOUND, PREPARATION OF THE COMPOUND AND USE OF THE COMPOUND AS A CATALYST BP CHEMICALS LIMITED (GB) 2003-07-31 WO disclosed
EP-0759301-B1 Prevention and treatment of topical viral infections with perfluoropolyethers or compositions thereof MANN MORRIS A (US) 2001-05-30 EP disclosed
EP-0670576-B1 Grazing incidence co-axial and confocal mirrors OSSERVATORIO ASTRONOMICO DI BR (IT) 1998-06-03 EP disclosed
US-5719194-A Prevention and treatment of topical viral infections with perfluoropolyethers or compositions thereof AUSIMONT S.P.A. (IT) 1998-02-17 US disclosed
EP-0759301-A2 Prevention and treatment of topical viral infections with perfluoropolyethers or compositions thereof MORRIS A. MANN (US) 1997-02-26 EP disclosed
US-5592338-A Grazing incidence co-axial and confocal OSSERVATORIO ASTRONOMICO DI BRERA (IT) 1997-01-07 US disclosed
US-5536339-A Air bag inflator gas compositions and inflator containing the same CONDUCTING MATERIALS CORPORATION (US) 1996-07-16 US disclosed
EP-0670576-A1 Grazing incidence co-axial and confocal mirrors OSSERVATORIO ASTRONOMICO DI BRERA (IT) 1995-09-06 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-20120330026-A1 PROCESS FOR THE PREPARATION OF TETRAZOLE DERIVATIVES FROM ORGANO BORON AND ORGANO ALUMINIUM AZIDES ABL1, TBCA, TBC1D5 CA1 524/4885CA9 228/4885ALDH1A1 3205/4885

“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.