Chloromethane

Chloromethane

SCHEMBL27353288

CCCCCCCCCCCCCCCCCC(=O)c1cccc(C)c1C.CCl.N

nearest known ligand 0.50

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Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTT P42858 2/20 0.50
MEN1 O00255 1/20 0.50
ALDH1A1 P00352 1/20 0.50
MAPT P10636 1/20 0.50
KMT2A Q03164 1/20 0.50
ATM Q13315 1/20 0.50
CHRM1 P11229 2/20 0.44
CHRM2 P08172 1/20 0.44
CHRM4 P08173 1/20 0.44
HTR1A P08908 1/20 0.44
CHRM5 P08912 1/20 0.44
ADRA2A P08913 1/20 0.44
DRD2 P14416 1/20 0.44
ADRA2B P18089 1/20 0.44
CHRM3 P20309 1/20 0.44
DRD4 P21917 1/20 0.44
ADRA1D P25100 1/20 0.44
ADRA1A P35348 1/20 0.44
HRH1 P35367 1/20 0.44
ADRA1B P35368 1/20 0.44

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
Ammonia Solution, Strong SCHEMBL27690137 0.97 HTT (0.53) HTTMEN1ALDH1A1MAPTKMT2A
SCHEMBL27614839 0.95 HTT (0.54) HTTMEN1ALDH1A1MAPTKMT2A
Ethylamine SCHEMBL27610075 0.91 HTT (0.50) HTTMEN1ALDH1A1MAPTKMT2A
SCHEMBL27886682 0.87 FAAH (0.57) ALDH1A1MAPTFAAH
SCHEMBL4458636 0.84 P2RX7 (0.46) HTTMEN1ALDH1A1MAPTKMT2A
SCHEMBL4451534 0.84 P2RX7 (0.46) HTTMEN1ALDH1A1MAPTKMT2A
SCHEMBL28144250 0.83 HTT (0.51) HTTMEN1ALDH1A1MAPTKMT2A
SCHEMBL10937745 0.82 CHRM1 (0.56) HTTMEN1ALDH1A1MAPTKMT2A
SCHEMBL8510526 0.82 CHRM1 (0.56) HTTMEN1ALDH1A1MAPTKMT2A
SCHEMBL5309095 0.82 CTNNB1 (0.46) ALDH1A1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-1065125-C Hair conditioning and styling components PROCTER & GAMBLE (US) 2001-05-02 CN disclosed
CN-1049786-A Hair nursing and Hairstyling composition PROCTER & GAMBLE (US) 1991-03-13 CN disclosed