SCHEMBL9010968

SCHEMBL9010968

O=C(O)CC1=CCC(CC(=O)O)C(CCO)C1

nearest known ligand 0.32

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
SLC6A12 P48065 3/20 0.32
SLC6A11 P48066 3/20 0.32
SLC6A13 Q9NSD5 3/20 0.32

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
SCHEMBL9010919 0.85 SLC6A12 (0.30) SLC6A12SLC6A11SLC6A13
SCHEMBL9010866 0.72 SLC6A12 (0.40) SLC6A12SLC6A11SLC6A13
SCHEMBL9010969 0.68 THRA (0.31)
SCHEMBL9010854 0.68 ALDH1A1 (0.33)
SCHEMBL21085058 0.65 SLC6A12 (0.36) SLC6A12SLC6A11SLC6A13
SCHEMBL21085030 0.64 HSD11B1 (0.36) SLC6A12SLC6A11SLC6A13
SCHEMBL16499292 0.62 SLC6A12 (0.50) SLC6A12SLC6A11SLC6A13
SCHEMBL2466288 0.62 SLC6A12 (0.50) SLC6A12SLC6A11SLC6A13
SCHEMBL16512741 0.62 SLC6A12 (0.50) SLC6A12SLC6A11SLC6A13
SCHEMBL9010952 0.62 CES2 (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 3 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
US-5557007-A Unsaturated polylactone acrylates and derivatives thereof UNION CARBIDE CHEMICALS & PLASTICS TECHNOLOGY CORPORATION (US) 1996-09-17 US disclosed
EP-0477983-A2 Unsaturated polylactone acrylates and derivatives thereof UNION CARBIDE CHEMICALS AND PLASTICS COMPANY, INC. (US) 1992-04-01 EP disclosed