Nitric Acid

Nitric Acid

SCHEMBL6034196

NC(N)=Nc1ccc(OCCn2ccnc2)cc1.O=[N+]([O-])O

nearest known ligand 0.60

Full drug profile on Sugi Atlas →

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.

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
TBXAS1 P24557 13/20 0.60
MEN1 O00255 1/20 0.54
LMNA P02545 1/20 0.54
KMT2A Q03164 1/20 0.54
KDM4E B2RXH2 1/20 0.53
ALDH1A1 P00352 1/20 0.53
MAPK1 P28482 1/20 0.53
NOS1 P29475 1/20 0.50

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
Nitric Acid SCHEMBL6034084 0.81 FURIN (0.52) TBXAS1
Nitric Acid SCHEMBL6034193 0.81 TBXAS1 (0.69) TBXAS1MEN1LMNAKMT2AKDM4E
Dazoxiben SCHEMBL8372980 0.80 TBXAS1 (0.85) TBXAS1MEN1LMNAKMT2A
Nitric Acid SCHEMBL6033962 0.80 FURIN (0.48) TBXAS1
Nitric Acid SCHEMBL6033724 0.80 SMN1; SMN2 (0.53) MEN1LMNAKMT2AKDM4EALDH1A1
SCHEMBL76423 0.78 KMT2A (0.64) TBXAS1MEN1LMNAKMT2AKDM4E
Hydrochloric Acid SCHEMBL7460532 0.77 TBXAS1 (0.59) TBXAS1KMT2AKDM4EALDH1A1NOS1
Nitric Acid SCHEMBL6034669 0.76 FURIN (0.63) ALDH1A1
SCHEMBL3005716 0.75 TBXAS1 (1.00) TBXAS1MEN1LMNAKMT2AKDM4E
SCHEMBL10749747 0.75 TBXAS1 (1.00) TBXAS1MEN1LMNAKMT2AKDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1187816-B1 5-CYANO-2-AMINOPYRIMIDINE DERIVATIVES CELLTECH R&D LTD (GB) 2006-12-20 EP disclosed
US-20040180914-A1 5-Cyano-2-aminopyrimidine derivatives CELLTECH R&D LIMTIED 2004-09-16 US disclosed
US-6579983-B1 Potent and selective inhibitors of receptor tyrosine kinases involved in angiogenesis, especially KDR kinase and/or FGFr kinase CELLTECH R&D LIMITED (GB) 2003-06-17 US disclosed
US-20020147339-A1 5-cyano-2-aminopyrimidine derivatives CELLTECH R&D LIMITED (GB) 2002-10-10 US disclosed
EP-1187816-A1 5-CYANO-2-AMINOPYRIMIDINE DERIVATIVES Celltech R&D Limited (GB) 2002-03-20 EP disclosed
WO-2000078731-A1 5-CYANO-2-AMINOPYRIMIDINE DERIVATIVES CELLTECH R&D LIMITED (GB) 2000-12-28 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 (2 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-20040180914-A1 5-Cyano-2-aminopyrimidine derivatives FLT1, FGFR1, KDR TBXAS1 296/4885MEN1 4739/4885LMNA 4343/4885
US-20020147339-A1 5-cyano-2-aminopyrimidine derivatives FLT1, FGFR1, KDR TBXAS1 282/4885MEN1 4769/4885LMNA 4323/4885

“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.