SCHEMBL7087331

SCHEMBL7087331

C=C(C)C(=O)OC.C=CC(=O)C1CNCCO1

nearest known ligand 0.41

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.41
SSTR4 P31391 14/20 0.38
REN P00797 3/20 0.34

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
SCHEMBL7090120 0.90 SSTR4 (0.34) ALDH1A1SSTR4REN
Styrene SCHEMBL27788864 0.88 SSTR4 (0.38) SSTR4REN
Methacrylic Acid SCHEMBL28322457 0.86 SSTR4 (0.38) SSTR4REN
Acrylic Acid Methyl Ester SCHEMBL28083255 0.85 SSTR4 (0.40) SSTR4REN
SCHEMBL9817840 0.85 SSTR4 (0.37) SSTR4REN
SCHEMBL28188110 0.85 SSTR4 (0.37) SSTR4REN
SCHEMBL36423 0.84 SSTR4 (0.41) SSTR4REN
SCHEMBL28246142 0.84 SSTR4 (0.41) SSTR4REN
SCHEMBL28057597 0.83 SSTR4 (0.34) ALDH1A1SSTR4REN
Acetamide SCHEMBL27603048 0.83 SSTR4 (0.40) SSTR4REN

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
CN-106978092-A PHOTOCURABLE RESIN COMPOSITION 日立化成株式会社 2017-07-25 CN disclosed
US-20030010668-A1 Desiccating container for moisture-sensitive material WEST PHARMACEUTICAL SERVICES, INC. 2003-01-16 US disclosed
US-5947274-A Desiccating container for moisture-sensitive material SMITHKLINE BEECHAM P.L.C. (GB) 1999-09-07 US disclosed