Nitric Acid

Nitric Acid

SCHEMBL16899082

Br.N.N.O=[N+]([O-])O

nearest known ligand 0.00

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Known targets — ChEMBL curated mechanism

ERG11

The experimentally established mechanism targets of Nitric Acid. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.

⚠ Novel chemotype — no close known analogue (best Tanimoto < 0.3). Unexplored chemical space relative to ChEMBL.

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
Nitric Acid SCHEMBL16899075 1.00
Nitric Acid SCHEMBL6034837 0.95 CA5A (0.89)
Nitric Acid SCHEMBL310885 0.95
Nitric Acid SCHEMBL11758696 0.95 CA5A (0.89)
Nitric Acid SCHEMBL11313025 0.95 CA5A (0.89)
Nitric Acid SCHEMBL11229873 0.95 CA5A (0.89)
Nitric Acid SCHEMBL1416 0.95
Nitric Acid SCHEMBL9189480 0.95 CA5A (0.89)
Nitric Acid SCHEMBL8101974 0.95 CA5A (0.89)
Nitric Acid SCHEMBL11220478 0.95 CA5A (0.89)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3092072-A1 A PROCESS FOR VAPOR-PHASE METHANOL CARBONYLATION TO METHYL FORMATE, A CATALYST USED IN THE PROCESS AND A METHOD FOR PREPARING THE CATALYST Fujian Institute Of Research On The Structure Of Matter, Chinese Academy Of Sciences (CN) 2016-11-16 EP disclosed
WO-2015103851-A1 A PROCESS FOR VAPOR-PHASE METHANOL CARBONYLATION TO METHYL FORMATE, A CATALYST USED IN THE PROCESS AND A METHOD FOR PREPARING THE CATALYST FUJIAN INSTITUTE OF RESEARCH ON THE STRUCTURE OF MATTER, CHINESE ACADEMY OF SCIENCES (CN) 2015-07-16 WO disclosed