SCHEMBL8215205

SCHEMBL8215205

CC(C)COC(O)O

nearest known ligand 0.00

⚠ Novel chemotype — no close known analogue (best Tanimoto < 0.3). Unexplored chemical space relative to ChEMBL.

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
SCHEMBL1263276 0.80
SCHEMBL5031952 0.77 CACNA2D1 (0.32)
SCHEMBL9730351 0.75 ALDH1A1 (0.32)
SCHEMBL23425572 0.75
SCHEMBL136443 0.75 ALDH1A1 (0.32)
SCHEMBL1263275 0.73
SCHEMBL20872366 0.73
SCHEMBL9668195 0.73 ALDH1A1 (0.31)
SCHEMBL15119453 0.73 TDP1 (0.41)
SCHEMBL3260888 0.73

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-109627162-B Process for preparing (7E) -7, 9-decanedioic acid esters 信越化学工业株式会社 2022-11-15 CN disclosed
EP-3466917-B1 METHOD FOR PREPARING (7E)- 7,9-DECADIENOATE ESTER SHINETSU CHEMICAL CO (JP) 2020-06-24 EP disclosed
US-10442752-B2 Method for preparing (7E)-7, 9-decadienoate ester SHIN-ETSU CHEMICAL CO., LTD. (JP) 2019-10-15 US disclosed
US-20190106374-A1 METHOD FOR PREPARING (7E)-7, 9-DECADIENOATE ESTER SHIN-ETSU CHEMICAL CO., LTD. (JP) 2019-04-11 US disclosed
EP-3466917-A1 METHOD FOR PREPARING (7E)- 7,9-DECADIENOATE ESTER Shin-Etsu Chemical Co., Ltd. (JP) 2019-04-10 EP disclosed
EP-0580308-B1 Working fluid composition for refrigeration machine KAO CORP (JP) 2000-11-15 EP disclosed
US-5395544-A Ester-containing working fluid composition for refrigerating machine KAO CORPORATION (JP) 1995-03-07 US disclosed
EP-0580308-A1 Working fluid composition for refrigeration machine KAO CORPORATION (JP) 1994-01-26 EP disclosed
US-4675400-A FORM CONJUGATES WITH IMMUNOGLOBULINS; ANTITUMOR AGENTS ELI LILLY AND COMPANY (US) 1987-06-23 US disclosed
EP-0206667-A2 Derivatives of 4-desacetyl indole-dihydroindole alkaloids ELI LILLY AND COMPANY (US) 1986-12-30 EP disclosed
EP-0076653-A1 Catalyst component and process for polymerization of olefins TOA NENRYO KOGYO KABUSHIKI KAISHA (JP) 1983-04-13 EP disclosed
EP-0044635-A1 Catalyst components for polymerization of alpha-olefins and a method for using them TOA NENRYO KOGYO KABUSHIKI KAISHA (JP) 1982-01-27 EP disclosed
US-3988356-A Novel haptenes and antigens ROUSSEL-UCLAF (FR) 1976-10-26 US disclosed
US-3975413-A Novel haptenes and antigens PIERDET ANDRE 1976-08-17 US disclosed