SCHEMBL9010958

SCHEMBL9010958

O=C(O)C1(CCCO)CC=CCC1

nearest known ligand 0.33

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
CYP4F2 P78329 1/20 0.33
CYP4A11 Q02928 1/20 0.33
TBXAS1 P24557 2/20 0.33

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
SCHEMBL9010882 0.89 CYP2C19 (0.31)
SCHEMBL22441539 0.84 CPB2 (0.34) TBXAS1
SCHEMBL21085027 0.79 TBXAS1 (0.38) CYP4F2CYP4A11TBXAS1
SCHEMBL29352013 0.76 SLC6A4 (0.33)
SCHEMBL7825176 0.76 CYP2C19 (0.50)
SCHEMBL2419343 0.76 CYP2C19 (0.32)
SCHEMBL873448 0.76 CYP2C19 (0.32)
SCHEMBL29988018 0.76 CYP2C19 (0.32)
SCHEMBL21085107 0.74 CYP4F2 (0.42) CYP4F2CYP4A11TBXAS1
SCHEMBL11741874 0.74 CYP2C19 (0.31)

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
EP-0477983-B1 Unsaturated polylactone acrylates and derivatives thereof UNION CARBIDE CHEM PLASTIC (US) 1996-11-13 EP disclosed
EP-0477983-A2 Unsaturated polylactone acrylates and derivatives thereof UNION CARBIDE CHEMICALS AND PLASTICS COMPANY, INC. (US) 1992-04-01 EP disclosed