SCHEMBL8650878

SCHEMBL8650878

O=C1CC(=O)OCCCCCCCCCCCCO1

nearest known ligand 0.60

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
CA1 P00915 1/20 0.60
CA9 Q16790 1/20 0.60
ALDH1A1 P00352 2/20 0.42
LMNA P02545 2/20 0.42
TP53 P04637 1/20 0.42
TSHR P16473 1/20 0.42
CYP2C9 P11712 1/20 0.31

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
SCHEMBL8651579 1.00 CA1 (0.60) CA1CA9ALDH1A1LMNATP53
SCHEMBL28379200 1.00 CA1 (0.60) CA1CA9ALDH1A1LMNATP53
SCHEMBL626027 1.00 CA1 (0.60) CA1CA9ALDH1A1LMNATP53
SCHEMBL31745727 1.00 CA1 (0.60) CA1CA9ALDH1A1LMNATP53
SCHEMBL30786390 1.00 CA1 (0.60) CA1CA9ALDH1A1LMNATP53
SCHEMBL11129170 1.00 CA1 (0.60) CA1CA9ALDH1A1LMNATP53
SCHEMBL7753310 0.97 CA1 (0.63) CA1CA9ALDH1A1LMNATP53
SCHEMBL3480461 0.90 CA1 (0.55) CA1CA9ALDH1A1LMNATP53
SCHEMBL12158586 0.90 CA1 (0.55) CA1CA9ALDH1A1LMNATP53
SCHEMBL12158580 0.83 LMNA (0.50) CA1CA9ALDH1A1LMNATP53

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 22 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-101106968-A 2 -C-substituted propane-1, 3 -dicarbonyl compounds and their use in neutralising malodour GIVAUDAN SA (CH) 2008-01-16 CN claimed
US-20250188501-A1 SEMISYNTHETIC ROUTES TO ORGANIC COMPOUNDS AGAIN BIO APS (DK) 2025-06-12 US disclosed
US-12188068-B2 Semisynthetic routes to organic compounds GENOMATICA, INC. (US) 2025-01-07 US disclosed
US-20210310033-A1 SEMISYNTHETIC ROUTES TO ORGANIC COMPOUNDS AGAIN BIO APS (DK) 2021-10-07 US disclosed
US-11008597-B2 Chemo-enzymatic process GENOMATICA, INC. (US) 2021-05-18 US disclosed
EP-3739057-A1 SEMISYNTHETIC ROUTES TO ORGANIC COMPOUNDS Genomatica, Inc. (US) 2020-11-18 EP disclosed
EP-3129492-B1 CHEMO-ENZYMATIC PROCESS FOR THE PREPARATION OF LACTONES AND MACROCYCLIC KETONES GENOMATICA INC (US) 2020-06-03 EP disclosed
EP-3129492-A1 SEMISYNTHETIC ROUTES TO ORGANIC COMPOUNDS REG Life Sciences, LLC (US) 2017-02-15 EP disclosed
US-20170029854-A1 SEMISYNTHETIC ROUTES TO ORGANIC COMPOUNDS REG Life Sciences, LLC (US) 2017-02-02 US disclosed
WO-2015157719-A9 SEMISYNTHETIC ROUTES TO ORGANIC COMPOUNDS REG Life Sciences, LLC (US) 2016-08-04 WO disclosed
US-5717111-A Process for the continuous preparation of macrocyclic compounds HUELS AKTIENGESELLSCHAFT (DE) 1998-02-10 US disclosed
EP-0260680-B1 Improved process for the production of macrocyclic esters by the depolymerization of polyesters HENKEL CORP (US) 1993-10-27 EP disclosed
EP-0260680-A2 Improved process for the production of macrocyclic esters by the depolymerization of polyesters HENKEL CORPORATION (US) 1988-03-23 EP disclosed
US-4709058-A Process for the production of macrocyclic esters by the depolymerization of polyesters NATIONAL DISTILLERS AND CHEMICAL CORPORATION (US) 1987-11-24 US disclosed
US-4594434-A Macrocyclic compounds NATIONAL DISTILLERS AND CHEMICAL CORPORATION (US) 1986-06-10 US disclosed
US-4499288-A THERMAL DEPOLYMERIZATION OF POLYESTERS; EFFICIENCY NATIONAL DISTILLERS AND CHEMICAL CORPORATION (US) 1985-02-12 US disclosed
US-4393223-A THERMAL DEPOLYMERIZATION OF POLYESTERS EMERY INDUSTRIES, INC. (US) 1983-07-12 US disclosed
US-4331603-A Process for improving the fragrance properties of macrocyclic compounds obtained by thermal depolymerization EMERY INDUSTRIES, INC. (US) 1982-05-25 US disclosed
US-4218379-A Process for the production of macrocyclic esters EMERY INDUSTRIES, INC. (US) 1980-08-19 US disclosed
US-4165321-A Process for the production of heterocyclic compounds HENKEL CORPORATION, A DE CORP. 1979-08-21 US disclosed