SCHEMBL29206147

SCHEMBL29206147

C=C(C)C(=O)OCC(CC)OC(=O)OC

nearest known ligand 0.52

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
TSHR P16473 3/20 0.52
ALDH1A1 P00352 3/20 0.42
THRB P10828 1/20 0.41
LMNA P02545 1/20 0.30
CA1 P00915 1/20 0.30
CA2 P00918 1/20 0.30

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
SCHEMBL19039725 0.91 TSHR (0.57) TSHRALDH1A1THRBLMNA
SCHEMBL15081562 0.89 TSHR (0.47) TSHRALDH1A1THRB
SCHEMBL158386 0.87 TSHR (0.57) TSHRALDH1A1THRBLMNA
SCHEMBL891298 0.84 TSHR (0.57) TSHRALDH1A1THRBCA1CA2
SCHEMBL18094690 0.83 TSHR (0.49) TSHRALDH1A1THRB
SCHEMBL9068269 0.83 TSHR (0.49) TSHRALDH1A1THRBLMNA
SCHEMBL28273817 0.83 TSHR (0.53) TSHRALDH1A1THRBLMNA
Ethylene Glycol SCHEMBL4333672 0.83 TSHR (0.52) TSHRALDH1A1THRBLMNA
SCHEMBL29143171 0.83 TSHR (0.52) TSHRALDH1A1THRBLMNA
SCHEMBL18094677 0.82 TSHR (0.47) TSHRALDH1A1THRB

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
CN-117980349-A Carbonate (meth) acrylate compositions 日油株式会社 2024-05-03 CN disclosed
WO-2023058511-A1 CARBONATE (METH)ACRYLATE COMPOSITION 日油株式会社 2023-04-13 WO disclosed