Chloromethane

Chloromethane

SCHEMBL1802833

CC(=CC(C)N)C(=O)O.CCl

nearest known ligand 0.41

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GABRP O00591 4/20 0.41
GABRD O14764 4/20 0.41
GABRA1 P14867 4/20 0.41
GABRB1 P18505 4/20 0.41
GABRG2 P18507 4/20 0.41
GABRB3 P28472 4/20 0.41
GABRA5 P31644 4/20 0.41
GABRA3 P34903 4/20 0.41
GABRA2 P47869 4/20 0.41
GABRB2 P47870 4/20 0.41
GABRA4 P48169 4/20 0.41
GABRE P78334 4/20 0.41
GABRA6 Q16445 4/20 0.41
GABRG1 Q8N1C3 4/20 0.41
GABRG3 Q99928 4/20 0.41
GABRQ Q9UN88 4/20 0.41
GRIK1 P39086 6/20 0.36
GRIA2 P42262 2/20 0.36
GRIA4 P48058 2/20 0.36
GRIK3 Q13003 2/20 0.36

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
SCHEMBL4356171 0.97
SCHEMBL127941 0.97
Hydrochloric Acid SCHEMBL2148370 0.95 GABRP (0.41) GABRPGABRDGABRA1GABRB1GABRG2
Bromide SCHEMBL10351104 0.95 GABRP (0.41) GABRPGABRDGABRA1GABRB1GABRG2
Trifluoroacetic Acid SCHEMBL30910755 0.89 GABRP (0.34) GABRPGABRDGABRA1GABRB1GABRG2
Chloromethane SCHEMBL1803776 0.83 GABRP (0.34) GABRPGABRDGABRA1GABRB1GABRG2
SCHEMBL18047809 0.79
SCHEMBL18047811 0.79
SCHEMBL8726425 0.78 PTGS1 (0.37) GABRPGABRDGABRA1GABRB1GABRG2
SCHEMBL8726421 0.78 PTGS1 (0.37) GABRPGABRDGABRA1GABRB1GABRG2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2017143136-A1 CORN SYRUP, AN INVERSION AID FOR WATER-IN-OIL POLYMER EMULSIONS ECOLAB USA INC. (US) 2017-08-24 WO claimed
US-9979037-B2 Process for producing fluorine containing polymer PIOTREK CO., LTD. (JP) 2018-05-22 US disclosed
US-20170040632-A1 PROCESS FOR PRODUCING FLUORINE CONTAINING POLYMER PIOTREK CO., LTD. (JP) 2017-02-09 US disclosed
US-9562126-B2 Process for producing fluorine containing polymer PIOTREK CO., LTD. (JP) 2017-02-07 US disclosed
US-8491969-B2 Redispersible polymer powder AKZO NOBEL N.V. (NL) 2013-07-23 US disclosed
US-20110104378-A1 REDISPERSIBLE POLYMER POWDER AKZO NOBEL N.V. (NL) 2011-05-05 US disclosed
US-4882087-A (METH)ACRYLAMIDE COPOLYMER, POLYOXYALKYLENE(ARYL)ETHER PHOSPHORIC ACID ESTER; PAPERMAKING SIZING AGENT; PURITY SEIKO KAGAKU KOGYO CO., LTD. (JP) 1989-11-21 US disclosed