SCHEMBL9628501

SCHEMBL9628501

Cc1nc[nH]c1CSCCN

nearest known ligand 0.58

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 1/20 0.58
HRH1 P35367 2/20 0.38
HRH4 Q9H3N8 2/20 0.38
HRH2 P25021 1/20 0.38
HRH3 Q9Y5N1 1/20 0.38
TDP1 Q9NUW8 1/20 0.37
SLC47A1 Q96FL8 1/20 0.34
PRMT6 Q96LA8 1/20 0.33
CYP1A2 P05177 2/20 0.33
CYP2D6 P10635 2/20 0.33
CYP2C19 P33261 2/20 0.33
CYP3A4 P08684 1/20 0.33
CYP2C9 P11712 1/20 0.33

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
Hydrochloric Acid SCHEMBL10458809 0.98 L3MBTL1 (0.61) L3MBTL1HRH1HRH4HRH2HRH3
Hydrochloric Acid SCHEMBL10458788 0.98 L3MBTL1 (0.61) L3MBTL1HRH1HRH4HRH2HRH3
Bromide SCHEMBL11311978 0.98 L3MBTL1 (0.57) L3MBTL1HRH1HRH4HRH2HRH3
Hydrochloric Acid SCHEMBL8600409 0.98 L3MBTL1 (0.61) L3MBTL1HRH1HRH4HRH2HRH3
Sulfuric Acid SCHEMBL10459948 0.91 L3MBTL1 (0.50) L3MBTL1HRH1HRH4HRH2HRH3
SCHEMBL11357850 0.90 L3MBTL1 (0.47) L3MBTL1HRH1HRH4HRH2HRH3
Bromide SCHEMBL11322608 0.88 L3MBTL1 (0.46) L3MBTL1HRH1HRH4HRH2HRH3
SCHEMBL11720334 0.84 L3MBTL1 (0.49) L3MBTL1HRH1HRH4HRH2HRH3
SCHEMBL11221673 0.82 L3MBTL1 (0.39) L3MBTL1SLC47A1CYP1A2CYP2D6CYP2C19
SCHEMBL11035051 0.82 L3MBTL1 (0.39) L3MBTL1HRH2TDP1SLC47A1CYP1A2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4916233-A Method for production of 4-methyl-5-(2-aminoethyl)-thiomethyl)-imidazole NIPPON SHOKUBAI KAGAKU KOGYO CO., LTD. (JP) 1990-04-10 US claimed
EP-0339970-A2 Method for production of 4-methyl-5-((2-aminoethyl)-thiomethyl)-imidazole NIPPON SHOKUBAI CO., LTD. (JP) 1989-11-02 EP claimed
US-4413129-A FROM 4-METHYL-5-HYDROXYMETHYLIMIDAZOLE AND 2-AMINOETHANETHIOLSULFURIC ACID SOGO PHARMACEUTICAL COMPANY, LTD. (JP) 1983-11-01 US claimed
US-4347373-A Derivatives of 4-methyl-5-[(2-aminoethyl)-thiomethyl]-imidazole TURCONI FRANCO 1982-08-31 US claimed
EP-0036684-A1 Derivatives of 4-methyl-5-(2-aminoethyl)-thiomethyl-imidazole having therapeutic activity Turconi, Franco (IT) 1981-09-30 EP claimed
EP-0004535-B1 PROCESS FOR PREPARING 4-METHYL-5-((2-AMINOETHYL)-THIOMETHYL)-IMIDAZOLE-DIHYDRO CHLORIDE BASF Aktiengesellschaft (DE) 1981-04-29 EP claimed
EP-0025443-A1 CYANO-UREAS, CYANO-THIOUREAS AND PREPARATION METHODS THEREOF SOCIETE DE RECHERCHES ET DE SYNTHESES ORGANIQUES SA (CH) 1981-03-25 EP claimed
EP-0006102-B1 1-HYDROXYMETHYLIMIDAZOLES, THEIR PREPARATION AND USE AS CHEMICAL INTERMEDIATES BASF Aktiengesellschaft (DE) 1981-02-11 EP claimed
WO-1980001914-A1 CYANO-UREAS,CYANO-THIOUREAS AND PREPARATION METHODS THEREOF RECH & SYNTHESES ORGANIQUES SA (CH) 1980-09-18 WO claimed
JP-2076858-A None JP disclosed
JP-2076858-A None JP disclosed
JP-2049773-A None JP disclosed
JP-59010582-A None JP disclosed
JP-58188860-A None JP disclosed
US-4018931-A INHIBITION OF H-2 HISTAMINE RECEPTORS SMITH KLINE & FRENCH LABORATORIES LIMITED (EN) 1977-04-19 US disclosed
US-4013769-A ANTIHISTAMINES SMITH KLINE & FRENCH LABORATORIES LIMITED (EN) 1977-03-22 US disclosed
US-4005205-A PYRIMIDINE COMPOUNDS SMITH KLINE & FRENCH LABORATORIES LIMITED (EN) 1977-01-25 US disclosed
US-4000302-A ANTIHISTAMINES SMITH KLINE & FRENCH LABORATORIES LIMITED (EN) 1976-12-28 US disclosed
US-3950353-A HISTAMINE INHIBITORS SMITH KLINE & FRENCH LABORATORIES LIMITED (EN) 1976-04-13 US disclosed
US-3950333-A HISTAMINE INHIBITORS, OXYALKYL, THIOALKYL, AMINOALKYL DERIVATIVES SMITH KLINE & FRENCH LABORATORIES LIMITED (EN) 1976-04-13 US disclosed