SCHEMBL6948533

SCHEMBL6948533

CCCCCCCCCCCCCCCCCCC(CCCCCCCCCCN(C)CCCCCCCCCCCCCCCCCC)C(=O)O

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GRIK1 P39086 2/20 0.54
GRIK2 Q13002 2/20 0.54
CA2 P00918 2/20 0.52
MAPK1 P28482 1/20 0.52
SLC1A2 P43004 1/20 0.51
SLC1A1 P43005 1/20 0.51
GPR84 Q9NQS5 3/20 0.50
FFAR1 O14842 1/20 0.50
KDM5A P29375 2/20 0.49
KDM4C Q9H3R0 2/20 0.49
PHF8 Q9UPP1 1/20 0.49
S1PR2 O95136 1/20 0.49
S1PR1 P21453 1/20 0.49
S1PR3 Q99500 1/20 0.49
S1PR5 Q9H228 1/20 0.49
MAPT P10636 1/20 0.48
LCK P06239 1/20 0.48
PPARD Q03181 1/20 0.48
ZDHHC20 Q5W0Z9 1/20 0.48
ZDHHC2 Q9UIJ5 1/20 0.48

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
SCHEMBL6942845 1.00 GRIK1 (0.54) GRIK1GRIK2CA2MAPK1SLC1A2
SCHEMBL6950336 1.00 GRIK1 (0.54) GRIK1GRIK2CA2MAPK1SLC1A2
Phosphoric Acid SCHEMBL2446039 0.93 S1PR2 (0.56) GRIK1GRIK2CA2MAPK1SLC1A2
SCHEMBL6945273 0.91 EPHX2 (0.51) GRIK1GRIK2FFAR1MAPTPPARD
SCHEMBL6942588 0.91 EPHX2 (0.51) GRIK1GRIK2FFAR1MAPTPPARD
Bromide SCHEMBL10571077 0.89 KDM4C (0.55) GPR84FFAR1KDM5AKDM4CPHF8
SCHEMBL17511725 0.89 DNM1 (0.56) GRIK1GRIK2CA2MAPK1SLC1A2
SCHEMBL25295583 0.86 GRIK1 (0.68) GRIK1GRIK2CA2MAPK1SLC1A2
SCHEMBL25286591 0.86 GRIK1 (0.68) GRIK1GRIK2CA2MAPK1SLC1A2
SCHEMBL25292827 0.86 GRIK1 (0.68) GRIK1GRIK2CA2MAPK1SLC1A2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0946699-B1 DRYER-ACTIVATED FABRIC CONDITIONING AND ANTISTATIC COMPOSITIONS WITH IMPROVED PERFUME LONGEVITY PROCTER & GAMBLE (US) 2003-10-15 EP claimed
EP-0704522-B1 Dryer-activated fabric conditioning compositions containing unsaturated fatty acid PROCTER & GAMBLE (US) 2001-11-28 EP claimed
EP-0712441-B1 DRYER-ACTIVATED FABRIC CONDITIONING COMPOSITIONS CONTAINING ETHOXYLATED/PROPOXYLATED SUGAR DERIVATIVES PROCTER & GAMBLE (US) 1999-10-20 EP claimed
EP-0712435-B1 DRYER-ACTIVATED FABRIC CONDITIONING AND ANTISTATIC COMPOSITIONS CONTAINING BIODEGRADABLE COMPOUNDS HAVING UNSATURATION PROCTER & GAMBLE (US) 1997-11-12 EP claimed
EP-0007135-B1 ARTICLES AND METHODS FOR TREATING FABRICS THE PROCTER & GAMBLE COMPANY (US) 1983-04-13 EP claimed