SCHEMBL3896154

SCHEMBL3896154

CCCCCCCCCCCCCCCCC(NC)C(=O)O

nearest known ligand 0.55

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
GPR84 Q9NQS5 7/20 0.55
FFAR1 O14842 2/20 0.55
NOD1 Q9Y239 3/20 0.54
MAPT P10636 1/20 0.53
LCK P06239 1/20 0.53
PPARD Q03181 1/20 0.53
ZDHHC20 Q5W0Z9 1/20 0.53
ZDHHC2 Q9UIJ5 1/20 0.53
ACE2 Q9BYF1 1/20 0.50
SLC6A5 Q9Y345 1/20 0.47
GRIK1 P39086 1/20 0.46
GRIK2 Q13002 1/20 0.46
FFAR4 Q5NUL3 1/20 0.46
ZDHHC7 Q9NXF8 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
SCHEMBL20366017 1.00 GPR84 (0.55) GPR84FFAR1NOD1MAPTLCK
SCHEMBL7182087 1.00 GPR84 (0.55) GPR84FFAR1NOD1MAPTLCK
SCHEMBL5135063 1.00 GPR84 (0.55) GPR84FFAR1NOD1MAPTLCK
SCHEMBL10352539 1.00 GPR84 (0.55) GPR84FFAR1NOD1MAPTLCK
SCHEMBL2809182 1.00 GPR84 (0.55) GPR84FFAR1NOD1MAPTLCK
SCHEMBL20447803 1.00 GPR84 (0.55) GPR84FFAR1NOD1MAPTLCK
SCHEMBL25208251 1.00 GPR84 (0.55) GPR84FFAR1NOD1MAPTLCK
Hydrochloric Acid SCHEMBL15799584 0.98 GPR84 (0.53) GPR84FFAR1NOD1MAPTLCK
SCHEMBL21102191 0.98 GPR84 (0.52) GPR84FFAR1NOD1MAPTLCK
SCHEMBL15451410 0.98 GPR84 (0.52) GPR84FFAR1NOD1MAPTLCK

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1044676-B1 Oily material composition AJINOMOTO KK (JP) 2009-03-18 EP disclosed
US-6447790-B1 OXO AMIDES, HAVING GOOD MOISTURE PERMEABILITY AND BARRIER, EMULSIFIER STABILITY AND FEEL, USED AS COSMETIC LOTIONS AJINOMOTO CO., INC. (JP) 2002-09-10 US disclosed
EP-1044676-A2 Oily material composition Ajinomoto Co., Inc. (JP) 2000-10-18 EP disclosed