Ammonia Solution, Strong

Ammonia Solution, Strong

SCHEMBL4843625

Cc1cc(N)ccc1CCc1ccccn1.N

nearest known ligand 0.50

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HRH1 P35367 2/20 0.50
L3MBTL1 Q9Y468 1/20 0.44
SYK P43405 1/20 0.43
HRH3 Q9Y5N1 2/20 0.42
MAOA P21397 1/20 0.42
MAOB P27338 1/20 0.42
ALDH1A1 P00352 2/20 0.41
LMNA P02545 1/20 0.41
TAAR1 Q96RJ0 1/20 0.41
ALOX15 P16050 1/20 0.41
CYP2D6 P10635 4/20 0.40
CYP1A2 P05177 4/20 0.40
CYP2C19 P33261 4/20 0.39
CYP2C9 P11712 3/20 0.39
CYP3A4 P08684 2/20 0.39
TDP1 Q9NUW8 1/20 0.39
KDM4E B2RXH2 1/20 0.39
CYP2E1 P05181 1/20 0.39
CYP2C8 P10632 1/20 0.39
CYP2B6 P20813 1/20 0.39

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
SCHEMBL14193180 0.83 HRH1 (0.55) HRH1L3MBTL1SYKHRH3MAOA
Hydrochloric Acid SCHEMBL3251435 0.81 HRH1 (0.53) HRH1L3MBTL1SYKHRH3MAOA
SCHEMBL18343654 0.80 SYK (0.55) HRH1L3MBTL1SYKHRH3MAOA
SCHEMBL7984784 0.80 HRH1 (0.55) HRH1L3MBTL1SYKHRH3MAOA
SCHEMBL24219689 0.79 KDM4E (0.55) HRH1HRH3ALDH1A1LMNATAAR1
SCHEMBL865950 0.78 ALDH1A1 (0.56) L3MBTL1ALDH1A1LMNATAAR1ALOX15
SCHEMBL3999395 0.77 HRH1 (0.51) HRH1L3MBTL1SYKHRH3MAOA
SCHEMBL6187553 0.75 CYP1A2 (0.51) HRH1HRH3MAOAMAOBALDH1A1
SCHEMBL23453426 0.75 HRH1 (0.57) HRH1L3MBTL1SYKHRH3MAOA
SCHEMBL27498217 0.75 HRH1 (0.49) HRH1SYKHRH3ALDH1A1LMNA

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
US-7429278-B2 N-alkyleheteroaryl secondary para-phenylenediamine and composition comprising such a para-phenylenediamine L'ORÉAL (FR) 2008-09-30 US claimed
US-20080069789-A1 N-ALKYLHETEROARYL SECONDARY PARA-PHENYLENEDIAMINE AND COMPOSITION COMPRISING SUCH A PARA-PHENYLENEDIAMINE L'OREAL S.A. 2008-03-20 US claimed
US-20060005320-A1 N-alkylheteroaryl secondary para-phenylenediamine and composition comprising such a para-phenylenediamine L'OREAL S.A. (FR) 2006-01-12 US claimed
EP-1589012-A2 N-alkylheteroaryl secondary para-phenyldiamine, dyeing composition containing the same, process for making it and uses thereof L'OREAL (FR) 2005-10-26 EP claimed
US-7429278-B2 N-alkyleheteroaryl secondary para-phenylenediamine and composition comprising such a para-phenylenediamine L'ORÉAL (FR) 2008-09-30 US disclosed
US-20080069789-A1 N-ALKYLHETEROARYL SECONDARY PARA-PHENYLENEDIAMINE AND COMPOSITION COMPRISING SUCH A PARA-PHENYLENEDIAMINE L'OREAL S.A. 2008-03-20 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-20080069789-A1 N-ALKYLHETEROARYL SECONDARY PARA-PHENYLENEDIAMINE AND COMPOSITION COMPRISING SUCH A PARA-PHENYLENEDIAMINE KRT18, CDC73, PRKDC HRH1 270/4885L3MBTL1 4708/4885SYK 4170/4885
US-20060005320-A1 N-alkylheteroaryl secondary para-phenylenediamine and composition comprising such a para-phenylenediamine KRT18, CDC73, PRKDC HRH1 270/4885L3MBTL1 4708/4885SYK 4170/4885

“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.