Hypochlorous Acid

Hypochlorous Acid

SCHEMBL5894756

CN(C)CCCl.OCl

nearest known ligand 0.00

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⚠ 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
SCHEMBL131951 0.93
Ammonia Solution, Strong SCHEMBL27883863 0.89
Hydrochloric Acid SCHEMBL4088567 0.89
Hydrochloric Acid SCHEMBL9244 0.89
Hydrochloric Acid SCHEMBL473400 0.86
Sulfuric Acid SCHEMBL11647815 0.82 MAPT (0.43)
SCHEMBL8997845 0.80 TSHR (0.50)
Mechlorethamine SCHEMBL12802922 0.79 MAPT (0.86)
Hydrochloric Acid SCHEMBL8950161 0.78 TSHR (0.50)
Acrylic Acid SCHEMBL19371529 0.74 LMNA (0.46)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7129361-B2 Thienylazolylalkoxyethanamines, their preparation and their application as medicaments LABORATORIOS DEL DR. ESTEVE, S.A. (ES) 2006-10-31 US disclosed
EP-1072266-B1 THIENYLAZOLYLALCOXYETHANAMINES, THEIR PREPARATION AND THEIR APPLICATION AS MEDICAMENTS ESTEVE LABOR DR (ES) 2005-08-24 EP disclosed
US-20040162324-A1 Thienylazolylalkoxyethanamines, their preparation and their application as medicaments LABORATORIOS DEL DR. ESTEVE, S.A. 2004-08-19 US disclosed
US-20020188017-A1 Thienylazolylalkoxyethanamines, their preparation and their application as medicaments LABORATORIOS DEL DR. ESTEVE, S.A. 2002-12-12 US disclosed
EP-1029852-B1 PROCESS FOR OBTAINING ENANTIOMERS OF CIS-OLIRTINE ESTEVE LABOR DR (ES) 2002-11-06 EP disclosed
US-6410582-B1 ANALGESICS LABORATORIOS DEL DR. ESTEVE, S.A. (ES) 2002-06-25 US disclosed
EP-1072266-A1 THIENYLAZOLYLALCOXYETHANAMINES, THEIR PREPARATION AND THEIR APPLICATION AS MEDICAMENTS LABORATORIOS DEL DR. ESTEVE, S.A. (ES) 2001-01-31 EP disclosed
US-6118009-A Process for obtaining enantiomers of cis-olirtine LABORATORIOS DEL DR. ESTEVE, S.A. (ES) 2000-09-12 US disclosed
EP-1029852-A1 PROCESS FOR OBTAINING ENANTIOMERS OF CIS-OLIRTINE LABORATORIOS DEL DR. ESTEVE, S.A. (ES) 2000-08-23 EP disclosed
US-4507499-A N-(4-Hydroxybenzyl)-3,4,5-trimethoxybenzamide and method for producing trimethobenzamide chlorohydrate FRANCIS S.P.A. (IT) 1985-03-26 US disclosed
US-4268439-A Basic azo dyestuffs having benzylammoniumamine substituent in the coupling component BAYER AKTIENGESELLSCHAFT (DE) 1981-05-19 US disclosed