SCHEMBL11166753

SCHEMBL11166753

CCCCCCCC(C)(C)C(C(=O)O)C(=O)O

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GPR84 Q9NQS5 6/20 0.45
FFAR1 O14842 2/20 0.45
PPARD Q03181 5/20 0.44
MAPT P10636 1/20 0.44
LCK P06239 1/20 0.44
ZDHHC20 Q5W0Z9 1/20 0.44
ZDHHC2 Q9UIJ5 1/20 0.44
CES2 O00748 1/20 0.42
CA2 P00918 1/20 0.42
MAPK1 P28482 1/20 0.42
GRIK1 P39086 1/20 0.42
GRIK2 Q13002 1/20 0.42
PPARG P37231 4/20 0.41
PPARA Q07869 4/20 0.41
TSHR P16473 3/20 0.41
HDAC11 Q96DB2 3/20 0.41
ALDH1A1 P00352 2/20 0.41
TDP1 Q9NUW8 2/20 0.41
SLC22A6 Q4U2R8 1/20 0.41
SLC22A8 Q8TCC7 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
SCHEMBL11161811 1.00 GPR84 (0.45) GPR84FFAR1PPARDMAPTLCK
SCHEMBL28727659 0.98 GPR84 (0.44) GPR84FFAR1PPARDMAPTLCK
SCHEMBL28729115 0.98 GPR84 (0.44) GPR84FFAR1PPARDMAPTLCK
SCHEMBL28727677 0.98 GPR84 (0.44) GPR84FFAR1PPARDMAPTLCK
SCHEMBL28727393 0.98 GPR84 (0.44) GPR84FFAR1PPARDMAPTLCK
SCHEMBL11160056 0.98 CA2 (0.43) GPR84FFAR1PPARDMAPTLCK
SCHEMBL9872143 0.85 CYP4F2 (0.44) GPR84FFAR1TSHRALDH1A1TDP1
SCHEMBL8037881 0.85 FFAR1 (0.40) FFAR1CA2MAPK1TDP1
SCHEMBL27780264 0.85 GPR84 (0.47) GPR84FFAR1PPARDMAPTLCK
SCHEMBL11108473 0.83 CYP4F2 (0.41) GPR84FFAR1CA2MAPK1TDP1

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
EP-0019578-B1 PIPERIDINE DERIVATIVES, PROCESS FOR PREPARING THEM AND POLYMER COMPOSITIONS CONTAINING THEM Chimosa Chimica Organica S.p.A. (IT) 1983-03-30 EP disclosed
EP-0019578-A1 Piperidine derivatives, process for preparing them and polymer compositions containing them Chimosa Chimica Organica S.p.A. (IT) 1980-11-26 EP disclosed