SCHEMBL8583237

SCHEMBL8583237

CCOCCCN1CN(CCCOCC)CN(CCCOCC)C1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.36
CYP2D6 P10635 1/20 0.36
CYP2C19 P33261 1/20 0.36
HTT P42858 1/20 0.33
HRH1 P35367 2/20 0.32
HRH3 Q9Y5N1 4/20 0.32
KDM4E B2RXH2 1/20 0.32
TDP1 Q9NUW8 1/20 0.32
MAPK1 P28482 2/20 0.32
CYP1A2 P05177 1/20 0.32
CHRM2 P08172 1/20 0.32
CHRM1 P11229 1/20 0.32
HTR2A P28223 1/20 0.32
SCN1A P35498 1/20 0.32
HTR2B P41595 1/20 0.32
KCNH2 Q12809 1/20 0.32
SCN2A Q99250 1/20 0.32
SIGMAR1 Q99720 1/20 0.32
SCN3A Q9NY46 1/20 0.32
L3MBTL1 Q9Y468 1/20 0.31

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
SCHEMBL29322718 0.85 MAPK1 (0.40) ALDH1A1CYP2D6CYP2C19HRH3KDM4E
SCHEMBL11569854 0.85
SCHEMBL8587238 0.83 TSHR (0.46) ALDH1A1HTTHRH3MAPK1CYP1A2
SCHEMBL10961176 0.83 CYP2D6 (0.41) ALDH1A1CYP2D6CYP2C19HRH1HRH3
SCHEMBL13334883 0.83 HRH3 (0.37) ALDH1A1HTTHRH1HRH3MAPK1
SCHEMBL8395657 0.82 HRH1 (0.41) ALDH1A1CYP2D6CYP2C19HTTHRH1
SCHEMBL24792370 0.81 HRH3 (0.43) ALDH1A1CYP2D6CYP2C19HRH1HRH3
SCHEMBL1161076 0.81 HRH3 (0.48) ALDH1A1CYP2D6CYP2C19HRH1HRH3
SCHEMBL1162928 0.79 HRH3 (0.52) ALDH1A1HRH1HRH3CHRM2KCNH2
SCHEMBL10245400 0.79 HRH3 (0.44) ALDH1A1HRH3KDM4ESIGMAR1USP2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3476478-B1 METHOD FOR REMOVING A SULFUR-CONTAINING COMPOUND KURARAY CO (JP) 2023-04-26 EP disclosed
CN-109310982-B Composition for removing sulfur-containing compounds 株式会社可乐丽(JP) 2023-01-13 CN disclosed
US-11291947-B2 Composition for removing sulfur-containing compound KURARAY CO., LTD. (JP) 2022-04-05 US disclosed
US-20190329175-A1 COMPOSITION FOR REMOVING SULFUR-CONTAINING COMPOUND KURARAY CO., LTD. (JP) 2019-10-31 US disclosed
EP-3283600-B1 METHOD OF REDUCING HYDROGEN SULFIDE LEVELS IN LIQUID OR GASEOUS STREAMS USING COMPOSITIONS COMPRISING TRIAZINES AND ANIONIC SURFACTANTS DOW GLOBAL TECHNOLOGIES LLC (US) 2019-09-25 EP disclosed
EP-3252129-B1 COMPOSITION FOR REMOVING SULFUR-CONTAINING COMPOUNDS KURARAY CO (JP) 2019-08-14 EP disclosed
US-10294428-B2 Composition for removing sulfur-containing compounds KURARAY CO., LTD. (JP) 2019-05-21 US disclosed
EP-3121251-B1 REMOVAL OF SULPHUR-CONTAINING COMPOUNDS KURARAY CO (JP) 2019-05-08 EP disclosed
EP-3476478-A1 COMPOSITION FOR REMOVING SULFUR-CONTAINING COMPOUND Kuraray Co., Ltd. (JP) 2019-05-01 EP disclosed
US-10155911-B2 Method of reducing hydrogen sulfide levels in gaseous mixtures using triazines DOW GLOBAL TECHNOLOGIES LLC (US) 2018-12-18 US disclosed
US-10119079-B2 Composition for removal of sulfur-containing compounds KURARAY CO., LTD. (JP) 2018-11-06 US disclosed
EP-3283600-A1 METHOD OF REDUCING HYDROGEN SULFIDE LEVELS IN LIQUID OR GASEOUS STREAMS USING COMPOSITIONS COMPRISING TRIAZINES AND ANIONIC SURFACTANTS Dow Global Technologies LLC (US) 2018-02-21 EP disclosed
US-20180044598-A1 METHOD OF REDUCING HYDROGEN SULFIDE LEVELS IN GASEOUS MIXTURES USING TRIAZINES DOW GLOBAL TECHNOLOGIES LLC 2018-02-15 US disclosed
US-20180010056-A1 COMPOSITION FOR REMOVING SULFUR-CONTAINING COMPOUNDS KURARAY CO., LTD. (JP) 2018-01-11 US disclosed
EP-3252129-A1 COMPOSITION FOR REMOVING SULFUR-CONTAINING COMPOUNDS Kuraray Co., Ltd. (JP) 2017-12-06 EP disclosed
US-20170081597-A1 COMPOSITION FOR REMOVAL OF SULFUR-CONTAINING COMPOUNDS KURARAY CO., LTD. (JP) 2017-03-23 US disclosed
EP-3121251-A1 COMPOSITION FOR REMOVAL OF SULPHUR-CONTAINING COMPOUNDS Kuraray Co., Ltd. (JP) 2017-01-25 EP disclosed
WO-2016167994-A1 METHOD OF REDUCING HYDROGEN SULFIDE LEVELS IN LIQUID OR GASEOUS STREAMS USING COMPOSITIONS COMPRISING TRIAZINES AND ANIONIC SURFACTANTS DOW GLOBAL TECHNOLOGIES LLC (US) 2016-10-20 WO disclosed
US-5744024-A SCAVENGING USING MIXTURE OF HEXAHYDRO-1,3,5-TRIAZINE AND QUATERNARY AMMONIUM COMPOUND NALCO/EXXON ENERGY CHEMICALS, L.P. (US) 1998-04-28 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 (1 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-10155911-B2 Method of reducing hydrogen sulfide levels in gaseous mixtures using triazines TST, GSS, SCLY ALDH1A1 1207/4885CYP2D6 3907/4885CYP2C19 2775/4885

“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.