SCHEMBL985970

SCHEMBL985970

O=CCCC1OCCO1

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
SCHEMBL7877477 0.90
SCHEMBL11288268 0.86
SCHEMBL3535726 0.85 HIF1A (0.41)
SCHEMBL22044036 0.83 HIF1A (0.39)
SCHEMBL21779473 0.78
SCHEMBL8838332 0.77
SCHEMBL16768948 0.77 HIF1A (0.38)
SCHEMBL8838402 0.77
SCHEMBL14128628 0.76
SCHEMBL5071835 0.75

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4374995-A Process for the production of tryptophane-hydantoin DEGUSSA AKTIENGESELLSCHAFT (DE) 1983-02-22 US claimed
EP-3510010-B1 TASTE MODULATING ALDEHYDE TAKASAGO PERFUMERY CO LTD (JP) 2023-09-06 EP disclosed
US-11540542-B2 Taste modulating aldehydes TAKASAGO INTERNATIONAL CORPORATION (JP) 2023-01-03 US disclosed
CN-109996778-B Taste modifying aldehydes 高砂香料工业株式会社 2022-12-13 CN disclosed
EP-3510010-A1 TASTE MODULATING ALDEHYDES Takasago International Corporation (JP) 2019-07-17 EP disclosed
US-20190208806-A1 TASTE MODULATING ALDEHYDES TAKASAGO INTERNATIONAL CORPORATION (JP) 2019-07-11 US disclosed
WO-2018049352-A1 TASTE MODULATING ALDEHYDES TAKASAGO INTERNATIONAL CORPORATION (USA) (US) 2018-03-15 WO disclosed
US-8835475-B2 Compounds as cannabinoid receptor ligands ABBVIE INC. (US) 2014-09-16 US disclosed
US-8501794-B2 Compounds as cannabinoid receptor ligands ABBVIE INC. (US) 2013-08-06 US disclosed
US-8188306-B2 Heat shock protein 90 inhibitors UNIVERSITY OF KANSAS (US) 2012-05-29 US disclosed
EP-0052200-B1 CYCLIC ACETALS OF N-ACYLATED GLUTAMIC ACID GAMMA-SEMIALDEHYDES, PROCESS FOR THEIR PREPARATION AND THEIR USE Degussa Aktiengesellschaft (DE) 1984-06-06 EP disclosed
EP-0052201-B1 CYCLIC ACETALS OF GLUTAMIC ACID GAMMA-SEMIALDEHYDE, PROCESS FOR THEIR PREPARATION AND THEIR USE Degussa Aktiengesellschaft (DE) 1984-05-30 EP disclosed
US-4424370-A N-ACYLTRYPTOPHANE INTERMEDIATES DEGUSSA AKTIENGESELLSCHAFT (DE) 1984-01-03 US disclosed
US-4376864-A Cyclic acetals of glutamic acid-γ-semialdehyde, process for their production and use DEGUSSA AG (DE) 1983-03-15 US disclosed
US-4374995-A Process for the production of tryptophane-hydantoin DEGUSSA AKTIENGESELLSCHAFT (DE) 1983-02-22 US disclosed
EP-0052200-A1 Cyclic acetals of N-acylated glutamic acid gamma-semialdehydes, process for their preparation and their use Degussa Aktiengesellschaft (DE) 1982-05-26 EP disclosed
EP-0052201-A1 Cyclic acetals of glutamic acid gamma-semialdehyde, process for their preparation and their use Degussa Aktiengesellschaft (DE) 1982-05-26 EP disclosed
EP-0052199-A1 Process for producing tryptophane hydantoin Degussa Aktiengesellschaft (DE) 1982-05-26 EP disclosed
US-4255587-A CARBONYLATION OF 2,6-DIALKYLANILINES USING AN OXO-SUBSTITUTED ESTER FOLLOWED BY CATALYTIC HYDROGENATION BASF AKTIENGESELLSCHAFT (DE) 1981-03-10 US disclosed
EP-0003304-A2 Process for the preparation of N-substituted 2,6-dialkyl anilines BASF Aktiengesellschaft (DE) 1979-08-08 EP disclosed