SCHEMBL21708352

SCHEMBL21708352

CCCCCCCC[C@@H](/C=C/CCCCCCC(=O)O)CO

nearest known ligand 0.66

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 1/20 0.66
PPARG P37231 5/20 0.63
TERT O14746 3/20 0.63
PTPN1 P18031 3/20 0.63
PPARD Q03181 3/20 0.63
PPARA Q07869 3/20 0.63
MAPT P10636 2/20 0.63
BLM P54132 2/20 0.63
HSD17B10 Q99714 2/20 0.63
FABP4 P15090 2/20 0.63
F7 P08709 2/20 0.63
F3 P13726 2/20 0.63
GMNN O75496 1/20 0.63
USP2 O75604 1/20 0.63
LMNA P02545 1/20 0.63
CYP1A2 P05177 1/20 0.63
POLB P06746 1/20 0.63
CYP2C9 P11712 1/20 0.63
ALOX15 P16050 1/20 0.63
APEX1 P27695 1/20 0.63

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
SCHEMBL20534392 1.00 ALOX5 (0.66) ALOX5PPARGTERTPTPN1PPARD
SCHEMBL21708270 1.00 ALOX5 (0.66) ALOX5PPARGTERTPTPN1PPARD
SCHEMBL28863748 1.00 ALOX5 (0.66) ALOX5PPARGTERTPTPN1PPARD
SCHEMBL20535104 1.00 ALOX5 (0.66) ALOX5PPARGTERTPTPN1PPARD
SCHEMBL8661531 0.92 PPARG (0.69) PPARGTERTPTPN1PPARDPPARA
SCHEMBL3211982 0.92 PPARG (0.69) PPARGTERTPTPN1PPARDPPARA
SCHEMBL15746818 0.92 PPARG (0.69) PPARGTERTPTPN1PPARDPPARA
SCHEMBL8661080 0.92 PPARG (0.69) PPARGTERTPTPN1PPARDPPARA
SCHEMBL15746809 0.92 PPARG (0.69) PPARGTERTPTPN1PPARDPPARA
SCHEMBL28972677 0.92 PPARG (0.69) PPARGTERTPTPN1PPARDPPARA

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-3609988-A1 NOVEL ESTER COMPOUNDS, METHOD FOR THE PRODUCTION THEREOF AND USE THEREOF Klüber Lubrication München SE & Co. KG (DE) 2020-02-19 EP disclosed