SCHEMBL27430508

SCHEMBL27430508

CCCCCCCCCCCCCCCC(=O)OC(=O)CC(=O)O

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PAM P19021 2/20 0.58
GPR84 Q9NQS5 7/20 0.56
PPARG P37231 7/20 0.56
PPARD Q03181 7/20 0.56
PPARA Q07869 7/20 0.56
HDAC11 Q96DB2 5/20 0.56
TSHR P16473 4/20 0.56
PTPN1 P18031 3/20 0.56
ALDH1A1 P00352 2/20 0.56
TLR2 O60603 2/20 0.56
TDP1 Q9NUW8 2/20 0.56
FABP4 P15090 2/20 0.56
KMT2A Q03164 2/20 0.56
SLC22A6 Q4U2R8 1/20 0.56
SLC22A8 Q8TCC7 1/20 0.56
MEN1 O00255 1/20 0.56
ESR1 P03372 1/20 0.56
ALOX15 P16050 1/20 0.56
PDE4A P27815 1/20 0.56
PDE3A Q14432 1/20 0.56

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
SCHEMBL28607908 1.00 PAM (0.58) PAMGPR84PPARGPPARDPPARA
SCHEMBL28066787 1.00 PAM (0.58) PAMGPR84PPARGPPARDPPARA
SCHEMBL11124211 0.90 DGKA (0.59) PAMGPR84PPARGPPARDPPARA
SCHEMBL11126247 0.90 DGKA (0.59) PAMGPR84PPARGPPARDPPARA
SCHEMBL29173152 0.90 DGKA (0.59) PAMGPR84PPARGPPARDPPARA
SCHEMBL11127787 0.90 DGKA (0.59) PAMGPR84PPARGPPARDPPARA
SCHEMBL29164118 0.90 DGKA (0.59) PAMGPR84PPARGPPARDPPARA
Decanoic Acid SCHEMBL25428676 0.88 GPR84 (0.74) PAMGPR84PPARGPPARDPPARA
SCHEMBL4305009 0.88 GPR84 (0.74) PAMGPR84PPARGPPARDPPARA
SCHEMBL3515484 0.88 GPR84 (0.74) PAMGPR84PPARGPPARDPPARA

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
CN-1106652-A Uncoated tablets and method of producing the same TAKEDA CHEMICAL INDUSTRIES LTD (JP) 1995-08-16 CN disclosed