SCHEMBL3829618

SCHEMBL3829618

CCCCCCCC(=O)OCOC(=O)CCCCCCCCCCC(=O)O

nearest known ligand 0.71

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PAM P19021 2/20 0.71
GPR84 Q9NQS5 7/20 0.71
PPARG P37231 7/20 0.71
PPARD Q03181 7/20 0.71
PPARA Q07869 7/20 0.71
HDAC11 Q96DB2 5/20 0.71
TSHR P16473 4/20 0.71
PTPN1 P18031 3/20 0.71
ALDH1A1 P00352 2/20 0.71
TLR2 O60603 2/20 0.71
TDP1 Q9NUW8 2/20 0.71
FABP4 P15090 2/20 0.71
KMT2A Q03164 2/20 0.71
ALOX15 P16050 2/20 0.71
HSD17B10 Q99714 2/20 0.71
SLC22A6 Q4U2R8 1/20 0.71
SLC22A8 Q8TCC7 1/20 0.71
MEN1 O00255 1/20 0.71
ESR1 P03372 1/20 0.71
PDE4A P27815 1/20 0.71

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
SCHEMBL6663733 1.00 PAM (0.71) PAMGPR84PPARGPPARDPPARA
Octanedioate SCHEMBL6666833 1.00 PAM (0.71) PAMGPR84PPARGPPARDPPARA
Adipic Acid SCHEMBL6662105 1.00 PAM (0.71) PAMGPR84PPARGPPARDPPARA
SCHEMBL3835587 1.00 PAM (0.71) PAMGPR84PPARGPPARDPPARA
SCHEMBL3836400 1.00 PAM (0.71) PAMGPR84PPARGPPARDPPARA
Azelaic Acid SCHEMBL6665373 1.00 PAM (0.71) PAMGPR84PPARGPPARDPPARA
Sebacic Acid SCHEMBL6661482 1.00 PAM (0.71) PAMGPR84PPARGPPARDPPARA
SCHEMBL3834773 1.00 PAM (0.71) PAMGPR84PPARGPPARDPPARA
Pimelic Acid SCHEMBL6662480 1.00 PAM (0.71) PAMGPR84PPARGPPARDPPARA
SCHEMBL27611253 1.00 PAM (0.71) 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
EP-1448508-B1 DOUBLE ESTERS DRUG DISCOVERY LAB AS (NO) 2009-09-23 EP disclosed