SCHEMBL8729473

SCHEMBL8729473

CCC(CO)(CO)CO.CCCCCCCCCCCCC(O)C(=O)O.CCCCCCCCCCCCC(O)C(=O)O.CCCCCCCCCCCCC(O)C(=O)O

nearest known ligand 0.75

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
GPR84 Q9NQS5 7/20 0.75
FFAR1 O14842 2/20 0.75
MAPT P10636 1/20 0.47
LCK P06239 1/20 0.47
PPARD Q03181 1/20 0.47
ZDHHC20 Q5W0Z9 1/20 0.47
ZDHHC2 Q9UIJ5 1/20 0.47
FFAR4 Q5NUL3 1/20 0.44
ACE2 Q9BYF1 1/20 0.44
HSPD1 P10809 1/20 0.41
BLM P54132 1/20 0.41
HSPE1 P61604 1/20 0.41
S1PR2 O95136 1/20 0.41
S1PR4 O95977 1/20 0.41
S1PR1 P21453 1/20 0.41
S1PR3 Q99500 1/20 0.41
GRIK1 P39086 1/20 0.41
GRIK2 Q13002 1/20 0.41

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
SCHEMBL9579859 0.93 GPR84 (0.81) GPR84FFAR1MAPTLCKPPARD
SCHEMBL29853894 0.93 GPR84 (0.81) GPR84FFAR1MAPTLCKPPARD
SCHEMBL8772485 0.93 GPR84 (0.81) GPR84FFAR1MAPTLCKPPARD
SCHEMBL8772473 0.93 GPR84 (0.81) GPR84FFAR1MAPTLCKPPARD
Alcohol SCHEMBL8607559 0.87 GPR84 (0.91) GPR84FFAR1MAPTLCKPPARD
Alcohol SCHEMBL28147971 0.87 GPR84 (0.91) GPR84FFAR1MAPTLCKPPARD
Alcohol SCHEMBL28203446 0.87 GPR84 (0.91) GPR84FFAR1MAPTLCKPPARD
SCHEMBL525377 0.87 GPR84 (1.00) GPR84FFAR1MAPTLCKPPARD
SCHEMBL2933185 0.87 GPR84 (1.00) GPR84FFAR1MAPTLCKPPARD
SCHEMBL525700 0.87 GPR84 (1.00) GPR84FFAR1MAPTLCKPPARD

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-0614918-B1 Polymerizable compositions and in-mold cured products using same TAKEMOTO OIL & FAT CO LTD (JP) 1998-10-21 EP disclosed
EP-0614918-A1 Polymerizable compositions and in-mold cured products using same Takemoto Yushi Kabushiki Kaisha (JP) 1994-09-14 EP disclosed
US-5331041-A Unsaturated esters containing carbamate groups TAKEMOTO YUSHI KABUSHIKI KAISHA (JP) 1994-07-19 US disclosed