Nitric Acid

Nitric Acid

SCHEMBL2076691

CN(C)c1ccc(NC(=N)N)cc1.O=[N+]([O-])O

nearest known ligand 0.53

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 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 9/20 0.53
SMN1; SMN2 Q16637 5/20 0.53
ALDH1A1 P00352 4/20 0.53
GAA P10253 3/20 0.53
KMT2A Q03164 3/20 0.53
BAZ1A Q9NRL2 1/20 0.48
NPC1 O15118 4/20 0.45
RAB9A P51151 4/20 0.45
MCL1 Q07820 3/20 0.45
LMNA P02545 3/20 0.44
ADRA2A P08913 2/20 0.43
NOX1 Q9Y5S8 2/20 0.43
TP53 P04637 1/20 0.43
ESR2 Q92731 1/20 0.43
NR4A1 P22736 1/20 0.43
HPGD P15428 1/20 0.43
TDP1 Q9NUW8 2/20 0.42
MAPK1 P28482 1/20 0.42
RECQL P46063 1/20 0.42
L3MBTL1 Q9Y468 1/20 0.42

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
SCHEMBL4154606 0.88 MAPT (0.66) MAPTSMN1; SMN2ALDH1A1GAAKMT2A
Nitric Acid SCHEMBL2076208 0.85 ALDH1A1 (0.52) MAPTSMN1; SMN2ALDH1A1KMT2ANPC1
Nitric Acid SCHEMBL9982936 0.81 LMNA (0.49) MAPTSMN1; SMN2ALDH1A1KMT2ANPC1
Nitric Acid SCHEMBL2073717 0.80 KMT2A (0.50) MAPTSMN1; SMN2ALDH1A1KMT2ARAB9A
Nitric Acid SCHEMBL2852035 0.80 PEPD (0.52) MAPTALDH1A1GAAKMT2ALMNA
Nitric Acid SCHEMBL2544082 0.78 NPC1 (0.53) MAPTALDH1A1GAAKMT2ANPC1
Nitric Acid SCHEMBL4613840 0.78 ALDH1A1 (0.53) MAPTSMN1; SMN2ALDH1A1GAAKMT2A
Nitric Acid SCHEMBL1833737 0.78 MEN1 (0.46) MAPTSMN1; SMN2ALDH1A1KMT2ANPC1
Nitric Acid SCHEMBL1184061 0.78 CA1 (0.44) KMT2ATP53CA9CA1CA2
Nitric Acid SCHEMBL3860512 0.78 KMT2A (0.59) MAPTSMN1; SMN2ALDH1A1GAAKMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1124779-B1 VITAMIN D ANALOGUES GALDERMA RES & DEV (FR) 2005-02-02 EP claimed
US-7897605-B2 Pyrimidine compounds CYCLACEL LIMITED (GB) 2011-03-01 US disclosed
EP-1641805-B1 THIAZOLO-, OXAZALO AND IMIDAZOLO-QUINAZOLINE COMPOUNDS CAPABLE OF INHIBITING PROTEIN KINASES CYCLACEL LTD (GB) 2010-01-13 EP disclosed
US-7576091-B2 Thiazolo-, oxazalo and imidazolo-quinazoline compounds capable of inhibiting protein kinases CYCLACEL LIMITED (GB) 2009-08-18 US disclosed
CN-100500663-C N-(4-(4-methylthiazol-5-yl) pyrimidin-2-yl) -n-phenylamines as antiproliferative compounds CYCLACEL LTD (GB) 2009-06-17 CN disclosed
US-20080287439-A1 Pyrimidine compounds CYCLACEL LIMITED (GB) 2008-11-20 US disclosed
CN-100425239-C Therapeutic applications of 2-substituted 4-heteroarylpyrimidines CYCLACEL LTD (GB) 2008-10-15 CN disclosed
US-7432260-B2 Pyrimidine compounds CYCLACEL LIMTED (GB) 2008-10-07 US disclosed
US-7427627-B2 N-(4-(4-methylthiazol-5-yl) pyrimidin-2-yl)-N-phenylamines as antiproliferative compounds CYCLACEL LIMITED (GB) 2008-09-23 US disclosed
CN-100404540-C Thiazolo-, oxazolo-and imidazoquinazoline compounds which inhibit protein kinases CYCLACEL LTD (GB) 2008-07-23 CN disclosed
EP-1124779-B1 VITAMIN D ANALOGUES GALDERMA RES & DEV (FR) 2005-02-02 EP disclosed
WO-2005005438-A1 THIAZOLO-, OXAZALO AND IMIDAZOLO-QUINAZOLINE COMPOUNDS CAPABLE OF INHIBITING PROT EIN KINASES CYCLACEL LIMITED (GB) 2005-01-20 WO disclosed
US-20040259894-A1 N-(4-(4-methylthiazol-5-yl)pyrimidin-2-yl)-N-phenylamines as antiproliferative compounds CYCLACEL LIMITED (GB) 2004-12-23 US disclosed
WO-2004056368-A1 THERAPEUTIC APPLICATIONS OF 2-SUBSTITUTED 4-HETEROARYLRYRIMIDINES CYCLACEL LIMITED (GB) 2004-07-08 WO disclosed
EP-1430051-A1 N-(4-(4-METHYLTHIAZOL-5-YL)PYRIMIDIN-2-YL)-N-PHENYLAMINES AS ANTIPROLIFERATIVE COMPOUNDS Cyclacel Limited (GB) 2004-06-23 EP disclosed
WO-2004043953-A1 PYRIMIDINE COMPOUNDS CYCLACEL LIMITED (GB) 2004-05-27 WO disclosed
WO-2004043467-A1 ANTI-VIRAL COMPOUNDS CYCLACEL LIMITED (GB) 2004-05-27 WO disclosed
WO-2003029248-A1 N-(4-(4-METHYLTHIAZOL-5-YL) PYRIMIDIN-2-YL) -N-PHENYLAMINES AS ANTIPROLIFERATIVE COMPOUNDS CYCLACEL LIMITED (GB) 2003-04-10 WO disclosed
EP-1124779-A1 VITAMIN D ANALOGUES Galderma Research & Development, S.N.C. (FR) 2001-08-22 EP disclosed
WO-2000026167-A1 VITAMIN D ANALOGUES GALDERMA RESEARCH & DEVELOPMENT, S.N.C. (FR) 2000-05-11 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-20040259894-A1 N-(4-(4-methylthiazol-5-yl)pyrimidin-2-yl)-N-phenylamines as antiproliferative compounds CDK4, CDK2, CDKL4 MAPT 1209/4885SMN1; SMN2 2905/4885ALDH1A1 2719/4885
US-20080287439-A1 Pyrimidine compounds CDK2, CCNI, CDK6 MAPT 1954/4885SMN1; SMN2 2791/4885ALDH1A1 2334/4885

“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.