SCHEMBL7166871

SCHEMBL7166871

CCCN(CCC)OC=O

nearest known ligand 0.32

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
ADH1A P07327 2/20 0.32
ADH1C P00326 1/20 0.32
CA1 P00915 1/20 0.32
ALDH1A1 P00352 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
SCHEMBL28284045 0.89 ADH1B (0.36) ADH1A
SCHEMBL27541605 0.84 TSHR (0.36) ADH1AADH1CCA1
SCHEMBL27352189 0.82 TSHR (0.35) ADH1AADH1CCA1
SCHEMBL28282435 0.82 ADH1C (0.39) ADH1AADH1CCA1ALDH1A1
SCHEMBL28172396 0.82 TSHR (0.35) ADH1AADH1CCA1
SCHEMBL28759784 0.82 TSHR (0.35) ADH1AADH1CCA1
SCHEMBL27514413 0.82 TSHR (0.35) ADH1AADH1CCA1
SCHEMBL28010770 0.80 ADH1C (0.38) ADH1AADH1CCA1ALDH1A1
SCHEMBL28125457 0.80 ADH1C (0.42) ADH1AADH1CCA1
SCHEMBL28286648 0.80 ADH1C (0.42) ADH1AADH1CCA1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-108558639-B Preparation method of calcium formate 厦门市汇创源科技有限公司 2021-01-12 CN disclosed
CN-106133004-B Catalyst component for olefin polymerization 巴塞尔聚烯烃意大利有限公司 2019-05-07 CN disclosed
CN-106133004-A Catalyst component for olefin polymerization 巴塞尔聚烯烃意大利有限公司 2016-11-16 CN disclosed
US-6506772-B1 Pharmaceutically active salts thereof with activity as adenosine receptor ligands are disclosed. These compounds are the adenosine receptor. HOFFMANN-LA ROCHE INC. 2003-01-14 US disclosed