SCHEMBL9852414

SCHEMBL9852414

CCCCCCCCCCCCOOC(C(=O)O)C(OOCCCCCCCCCCCC)C(=O)O

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HCAR2 Q8TDS4 2/20 0.46
GPR84 Q9NQS5 7/20 0.44
FFAR1 O14842 2/20 0.44
NAAA Q02083 1/20 0.44
PPARD Q03181 7/20 0.42
CES2 O00748 1/20 0.42
MAPT P10636 1/20 0.42
LCK P06239 1/20 0.42
ZDHHC20 Q5W0Z9 1/20 0.42
ZDHHC2 Q9UIJ5 1/20 0.42
EPHX1 P07099 1/20 0.41
PPARG P37231 6/20 0.40
PPARA Q07869 6/20 0.40
HDAC11 Q96DB2 5/20 0.40
TSHR P16473 4/20 0.40
ALDH1A1 P00352 2/20 0.40
TLR2 O60603 2/20 0.40
TDP1 Q9NUW8 2/20 0.40
FABP4 P15090 2/20 0.40
PTPN1 P18031 2/20 0.40

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
SCHEMBL31731944 0.82 ACE2 (0.41) HCAR2GPR84FFAR1NAAAPPARD
SCHEMBL9978252 0.80 HCAR2 (0.35) HCAR2GPR84FFAR1NAAAPPARD
SCHEMBL29117104 0.79 GPR84 (0.48) GPR84FFAR1NAAAPPARDMAPT
SCHEMBL9852321 0.79 NAAA (0.40) HCAR2NAAACES2EPHX1TSHR
SCHEMBL29162228 0.79 GPR84 (0.44) HCAR2GPR84FFAR1NAAAPPARD
SCHEMBL7933377 0.79 GPR84 (0.48) GPR84FFAR1NAAAPPARDMAPT
SCHEMBL27531974 0.79 GPR84 (0.48) GPR84FFAR1NAAAPPARDMAPT
SCHEMBL15282661 0.79 GPR84 (0.48) GPR84FFAR1NAAAPPARDMAPT
SCHEMBL453154 0.79 HCAR2 (0.48) HCAR2GPR84FFAR1NAAAPPARD
SCHEMBL5718514 0.79 HCAR2 (0.48) HCAR2GPR84FFAR1NAAAPPARD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0433188-A1 Possibly thermotropic polymolecular associations based on hydrogen bonded monomers, process for their preparation and monomers for carrying out this process RHONE-POULENC CHIMIE (FR) 1991-06-19 EP disclosed