SCHEMBL8997387

SCHEMBL8997387

CCCCCCCCCCCC(=O)O[C@](C)(CCCC)C(=O)O

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PAM P19021 2/20 0.51
DGKA P23743 1/20 0.47
LMNA P02545 2/20 0.44
GPR84 Q9NQS5 7/20 0.44
PPARG P37231 7/20 0.44
PPARD Q03181 7/20 0.44
PPARA Q07869 7/20 0.44
HDAC11 Q96DB2 5/20 0.44
TSHR P16473 4/20 0.44
PTPN1 P18031 3/20 0.44
ALDH1A1 P00352 2/20 0.44
TLR2 O60603 2/20 0.44
TDP1 Q9NUW8 2/20 0.44
FABP4 P15090 2/20 0.44
SLC22A6 Q4U2R8 1/20 0.44
SLC22A8 Q8TCC7 1/20 0.44
MEN1 O00255 1/20 0.44
ESR1 P03372 1/20 0.44
ALOX15 P16050 1/20 0.44
PDE4A P27815 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
SCHEMBL28246112 0.97 PAM (0.47) PAMDGKALMNAGPR84PPARG
SCHEMBL28022796 0.97 PAM (0.47) PAMDGKALMNAGPR84PPARG
SCHEMBL28022715 0.97 PAM (0.47) PAMDGKALMNAGPR84PPARG
SCHEMBL17023973 0.89 ALDH1A1 (0.40) PAMDGKAGPR84PPARGPPARD
SCHEMBL17023958 0.89 ALDH1A1 (0.40) PAMDGKAGPR84PPARGPPARD
SCHEMBL15618808 0.89 ALDH1A1 (0.40) PAMDGKAGPR84PPARGPPARD
SCHEMBL2250835 0.86 PAM (0.46) PAMDGKALMNAGPR84PPARG
SCHEMBL28023338 0.84 NAAA (0.44) PAMGPR84PPARGPPARDPPARA
SCHEMBL28022853 0.84 NAAA (0.44) PAMGPR84PPARGPPARDPPARA
SCHEMBL17023971 0.84 NAAA (0.38) PAMTSHRALDH1A1

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-0459455-B1 Process for producing optically active alpha-hydroxyesters CHISSO CORP (JP) 1996-09-04 EP disclosed