SCHEMBL7947011

SCHEMBL7947011

CCCCCC=CCCCC(CCCC=CCCCCC)C(=O)O

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CA2 P00918 1/20 0.55
▸ MAPK1 P28482 1/20 0.55
▸ TERT O14746 3/20 0.55
▸ PTPN1 P18031 3/20 0.55
▸ PPARG P37231 3/20 0.55
▸ PPARD Q03181 3/20 0.55
▸ PPARA Q07869 3/20 0.55
▸ TOP1 P11387 3/20 0.55
▸ MAPT P10636 2/20 0.55
▸ BLM P54132 2/20 0.55
▸ HSD17B10 Q99714 2/20 0.55
▸ FABP4 P15090 2/20 0.55
▸ CHRM1 P11229 2/20 0.55
▸ TDP1 Q9NUW8 2/20 0.55
▸ GMNN O75496 1/20 0.55
▸ USP2 O75604 1/20 0.55
▸ LMNA P02545 1/20 0.55
▸ CYP1A2 P05177 1/20 0.55
▸ POLB P06746 1/20 0.55
▸ CYP2C9 P11712 1/20 0.55

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
SCHEMBL16543225 1.00 CA2 (0.55) CA2MAPK1TERTPTPN1PPARG
SCHEMBL18114511 0.94 TERT (0.58) TERTPTPN1PPARGPPARDPPARA
SCHEMBL2212781 0.94 TERT (0.58) TERTPTPN1PPARGPPARDPPARA
SCHEMBL12448055 0.94 TERT (0.58) TERTPTPN1PPARGPPARDPPARA
SCHEMBL25286066 0.94 TERT (0.58) TERTPTPN1PPARGPPARDPPARA
SCHEMBL25292067 0.94 TERT (0.58) TERTPTPN1PPARGPPARDPPARA
SCHEMBL4349650 0.94 TERT (0.58) TERTPTPN1PPARGPPARDPPARA
SCHEMBL9224800 0.94 TERT (0.58) TERTPTPN1PPARGPPARDPPARA
SCHEMBL2212783 0.94 TERT (0.58) TERTPTPN1PPARGPPARDPPARA
SCHEMBL502596 0.94 TERT (0.58) TERTPTPN1PPARGPPARDPPARA

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
WO-2001013741-A1 CIS-DEC-4-ENYL ACETATE AS A FLAVORING AGENT AND METHODS FOR PREPARING AND USING SAME BUSH BOAKE ALLEN INC. (US) 2001-03-01 — — WO disclosed
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