Ammonia Solution, Strong

Ammonia Solution, Strong

SCHEMBL14322575

N.Nc1cccc2ncccc12

nearest known ligand 0.69

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NCF1 P14598 1/20 0.69
LMNA P02545 3/20 0.59
KMT2A Q03164 3/20 0.59
MAPT P10636 2/20 0.59
HSP90AA1 P07900 2/20 0.59
HSP90AB1 P08238 2/20 0.59
MEN1 O00255 2/20 0.59
HTT P42858 1/20 0.59
BLM P54132 1/20 0.59
HIF1A Q16665 1/20 0.59
KDM4E B2RXH2 2/20 0.56
NR4A2 P43354 2/20 0.53
ALDH1A1 P00352 4/20 0.50
CYP3A4 P08684 3/20 0.50
HPGD P15428 3/20 0.50
TSHR P16473 2/20 0.50
HSD17B10 Q99714 2/20 0.50
TDP1 Q9NUW8 1/20 0.50
POLB P06746 2/20 0.47
IDO1 P14902 1/20 0.46

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
SCHEMBL115674 0.98 NCF1 (0.72) NCF1LMNAKMT2AMAPTHSP90AA1
SCHEMBL29961464 0.98 NCF1 (0.72) NCF1LMNAKMT2AMAPTHSP90AA1
Hydrochloric Acid SCHEMBL29862816 0.96 NCF1 (0.69) NCF1LMNAKMT2AMAPTHSP90AA1
Hydrochloric Acid SCHEMBL6119015 0.96 NCF1 (0.69) NCF1LMNAKMT2AMAPTHSP90AA1
Aniline SCHEMBL2858457 0.88 NCF1 (0.66) NCF1LMNAKMT2AMAPTHSP90AA1
Pyrimidine SCHEMBL28845436 0.88 NCF1 (0.60) NCF1LMNAKMT2AMAPTHSP90AA1
Quinolin-4-Amine SCHEMBL20986747 0.84 NCF1 (0.95) NCF1LMNAKMT2AMAPTHSP90AA1
Hydrazinecarboxamide SCHEMBL1464164 0.82 NCF1 (0.53) NCF1LMNAKMT2AMAPTHSP90AA1
Quinolin-4-Amine SCHEMBL278276 0.82 NCF1 (1.00) NCF1LMNAKMT2AMAPTHSP90AA1
Quinolin-4-Amine SCHEMBL29493365 0.82 NCF1 (1.00) NCF1LMNAKMT2AMAPTHSP90AA1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-109400594-A Metal enzyme inhibitor compound 威尔金制药(NC)有限公司 2019-03-01 CN disclosed
EP-2723731-B1 METALLOENZYME INHIBITOR COMPOUNDS VIAMET PHARMACEUTICALS INC (US) 2017-10-25 EP disclosed
US-8940735-B2 Metalloenzyme inhibitor compounds VIAMET PHARMACEUTICALS, INC. (US) 2015-01-27 US disclosed
US-8883797-B2 Metalloenzyme inhibitor compounds VIAMET PHARMACEUTICALS, INC. (US) 2014-11-11 US disclosed
CN-103930418-A Metalloenzyme inhibitor compounds VIAMET PHARMACEUTICALS INC 2014-07-16 CN disclosed
CN-103857675-A Metalloenzyme inhibitor compounds VIAMET PHARMACEUTICALS INC 2014-06-11 CN disclosed
EP-2723730-A1 METALLOENZYME INHIBITOR COMPOUNDS Viamet Pharmaceuticals, Inc. (US) 2014-04-30 EP disclosed
EP-2723731-A1 METALLOENZYME INHIBITOR COMPOUNDS Viamet Pharmaceuticals, Inc. (US) 2014-04-30 EP disclosed
US-20130012503-A1 METALLOENZYME INHIBITOR COMPOUNDS VIAMET PHARMACEUTICALS, INC. (US) 2013-01-10 US disclosed
WO-2012177725-A1 METALLOENZYME INHIBITOR COMPOUNDS VIAMET PHARMACEUTICALS, INC. (US) 2012-12-27 WO disclosed
WO-2012177728-A1 METALLOENZYME INHIBITOR COMPOUNDS VIAMET PHARMACEUTICALS, INC. (US) 2012-12-27 WO disclosed
US-20120329802-A1 METALLOENZYME INHIBITOR COMPOUNDS VIAMET PHARMACEUTICALS, INC. (US) 2012-12-27 US 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-20130012503-A1 METALLOENZYME INHIBITOR COMPOUNDS MMEL1, GPX1, MPO NCF1 939/4885LMNA 4266/4885KMT2A 1886/4885
US-20120329802-A1 METALLOENZYME INHIBITOR COMPOUNDS MMEL1, GPX1, MPO NCF1 939/4885LMNA 4266/4885KMT2A 1886/4885

“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.