SCHEMBL5953370

SCHEMBL5953370

COc1cc(OCCCC(=O)O)ccc1COC(C)=O

nearest known ligand 0.48

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ FFAR1 O14842 5/20 0.45
▸ DHFR P00374 1/20 0.45
▸ POLB P06746 1/20 0.44
▸ FFAR4 Q5NUL3 4/20 0.44
▸ LTB4R Q15722 1/20 0.43
▸ PTPN1 P18031 1/20 0.42
▸ PPARG P37231 1/20 0.42
▸ PPARD Q03181 1/20 0.42
▸ PPARA Q07869 1/20 0.42
▸ TSHR P16473 1/20 0.42

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
SCHEMBL29402124 0.84 DHFR (0.48) FFAR1DHFRFFAR4PTPN1PPARG
SCHEMBL120379 0.84 DHFR (0.48) FFAR1DHFRFFAR4PTPN1PPARG
SCHEMBL17593842 0.83 DHFR (0.50) FFAR1DHFRFFAR4PTPN1PPARG
SCHEMBL27168283 0.82 FFAR1 (0.49) FFAR1DHFR
SCHEMBL27168286 0.82 FFAR1 (0.49) FFAR1DHFR
SCHEMBL30063540 0.82 FFAR1 (0.49) FFAR1DHFR
SCHEMBL27621744 0.82 APLNR (0.53) POLB
SCHEMBL10335441 0.81 LMNA (0.53) FFAR1DHFRPOLBFFAR4PPARG
SCHEMBL16790724 0.80 CNR1 (0.43) FFAR1
SCHEMBL1229002 0.80 DHFR (0.53) FFAR1DHFRPTPN1PPARGPPARD

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20060052532-A1 Swellable, easily cross-linked, essentially linear polymers, and the use of the same in solid phase synthesis FORSCHUNGSVERBUND BERLIN E.V. (DE) 2006-03-09 — — US disclosed
WO-2003085031-A1 SWELLABLE, EASILY CROSS-LINKED, ESSENTIALLY LINEAR POLYMERS, AND THE USE OF THE SAME IN SOLID PHASE SYNTHESIS RADEMANN JOERG (DE) 2003-10-16 — — WO disclosed
Send feedback