Chloromethane

Chloromethane

SCHEMBL9628755

CCCN(CCC)CCC.CCl

nearest known ligand 0.38

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Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HRH3 Q9Y5N1 1/20 0.38
CA12 O43570 4/20 0.36
CA2 P00918 4/20 0.36
CA9 Q16790 3/20 0.36
DRD2 P14416 4/20 0.36
DRD3 P35462 4/20 0.36
HTR1A P08908 1/20 0.36
LMNA P02545 1/20 0.35
CA1 P00915 4/20 0.35
DRD1 P21728 2/20 0.34
DRD4 P21917 2/20 0.34
DRD5 P21918 2/20 0.34
CYP3A4 P08684 1/20 0.34
CYP2D6 P10635 1/20 0.34
TSHR P16473 1/20 0.34
NFKB1 P19838 1/20 0.34
ADRA1D P25100 1/20 0.34
ADRA1A P35348 1/20 0.34
ADRA1B P35368 1/20 0.34
HIF1A Q16665 1/20 0.34

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
SCHEMBL2729745 0.91 HRH3 (0.41) HRH3CA12CA2CA9DRD2
SCHEMBL5358 0.91 HRH3 (0.41) HRH3CA12CA2CA9DRD2
SCHEMBL21224483 0.91 HRH3 (0.41) HRH3CA12CA2CA9DRD2
Methylene Chloride SCHEMBL6682460 0.88 LMNA (0.41) HRH3CA12CA2CA9DRD2
SCHEMBL756023 0.87 HRH3 (0.39) HRH3CA12CA2CA9DRD2
Iodide SCHEMBL1758226 0.87 HRH3 (0.39) HRH3CA12CA2CA9DRD2
Fluoride SCHEMBL64252 0.87 HRH3 (0.39) HRH3CA12CA2CA9DRD2
SCHEMBL10948053 0.87 HRH3 (0.39) HRH3CA12CA2CA9DRD2
SCHEMBL14270553 0.87 HRH3 (0.39) HRH3CA12CA2CA9DRD2
Hydrochloric Acid SCHEMBL210163 0.87 HRH3 (0.39) HRH3CA12CA2CA9DRD2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-101463119-A Reactive isocyanate compositions EVONIK DEGUSSA GMBH (DE) 2009-06-24 CN claimed
CN-101463221-A Dual cure formulations with components comprising uretdione groups EVONIK DEGUSSA GMBH (DE) 2009-06-24 CN claimed
CN-101139461-A Low-temperature-curable polyurethane compositions containing uretdione groups and with quaternary ammonium halides DEGUSSA (DE) 2008-03-12 CN claimed
EP-0229714-B1 POLYMERIZATION OF AROMATIC POLYAMIDES E.I. DU PONT DE NEMOURS AND COMPANY (US) 1992-05-20 EP claimed
US-4737571-A REACTING PHENYLENEDIAMINE WITH TEREPHTHALOYL CHLORIDE E. I. DU PONT DE NEMOURS AND COMPANY (US) 1988-04-12 US claimed
EP-0229714-A2 Polymerization of aromatic polyamides E.I. DU PONT DE NEMOURS AND COMPANY (US) 1987-07-22 EP claimed
CN-108863966-A The method for preparing the trimer and/or oligomer of diisocyanate 赢创德固赛有限公司 2018-11-23 CN disclosed
CN-101497686-B Dryblend process for preparing high-reactivity polyurethane compositions containing uretdione groups EVONIK DEGUSSA GMBH (DE) 2014-10-22 CN disclosed
CN-101497686-A Dryblend process for preparing high-reactivity polyurethane compositions containing uretdione groups EVONIK DEGUSSA GMBH (DE) 2009-08-05 CN disclosed
CN-101463119-A Reactive isocyanate compositions EVONIK DEGUSSA GMBH (DE) 2009-06-24 CN disclosed
CN-101463221-A Dual cure formulations with components comprising uretdione groups EVONIK DEGUSSA GMBH (DE) 2009-06-24 CN disclosed
CN-101139461-A Low-temperature-curable polyurethane compositions containing uretdione groups and with quaternary ammonium halides DEGUSSA (DE) 2008-03-12 CN disclosed
CN-1635992-A Solventless synthesis of hydrophilic phenol ester derivatives PROCTER & GAMBLE (US) 2005-07-06 CN disclosed
EP-0229714-B1 POLYMERIZATION OF AROMATIC POLYAMIDES E.I. DU PONT DE NEMOURS AND COMPANY (US) 1992-05-20 EP disclosed