SCHEMBL97616

SCHEMBL97616

CCCCC1CC1

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
SCHEMBL5691762 1.00 CYP1A2 (0.74) —
Ammonia Solution, Strong SCHEMBL28122694 0.97 CYP1A2 (0.70) —
Ammonia Solution, Strong SCHEMBL266627 0.97 — —
Bromide SCHEMBL9836407 0.97 — —
SCHEMBL10568305 0.97 CYP1A2 (0.70) —
Water SCHEMBL17800056 0.97 — —
Iodide SCHEMBL8824339 0.97 — —
SCHEMBL10568311 0.97 CYP1A2 (0.70) —
Methyl Alcohol SCHEMBL2872344 0.94 — —
SCHEMBL8462718 0.94 CYP1A2 (0.67) —

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240131040-A1 COMPOSITIONS AND METHODS RELATED TO CANNABINOID ANIONS Natural Extraction Systems, LLC (US) 2024-04-25 — — US claimed
WO-2023197658-A1 LIGHT-EMITTING DEVICE, PREPARATION METHOD FOR LIGHT-EMITTING DEVICE, AND DISPLAY APPARATUS TCL科技集团股份有限公司 2023-10-19 — — WO claimed
WO-2023141852-A1 CDK2 INHIBITORS, PREPARATION METHOD THEREFOR AND USE THEREOF 益方生物科技(上海)股份有限公司 2023-08-03 — — WO claimed
US-20230089351-A1 METHODS RELATED TO BIOACTIVE AGENTS THAT CONVERT FROM ANIONS TO MOLECULES Natural Extraction Systems, LLC (US) 2023-03-23 — — US claimed
US-20230073802-A1 COMPOSITIONS AND METHODS RELATED TO CANNABINOID ANIONS Natural Extraction Systems, LLC (US) 2023-03-09 — — US claimed
US-20220387351-A1 Compositions and Methods Related to Organic Oxides Natural Extraction Systems, LLC 2022-12-08 — — US claimed
US-20220387376-A1 Compositions Comprising Cannabinoid Molecules that are Dissolved in Water-Miscible Solvents NATURAL EXTRACTION SYS LLC (US) 2022-12-08 — — US claimed
WO-2022026960-A1 COMPOSITIONS AND METHODS RELATED TO EXCIPIENTS AND CANNABINOID FORMULATIONS Natural Extraction Systems, LLC (US) 2022-02-03 — — WO claimed
US-20210360947-A1 COMPOSITIONS AND METHODS RELATED TO EXCIPIENTS AND CANNABINOID FORMULATIONS Natural Extraction Systems, LLC 2021-11-25 — — US claimed
WO-2021158573-A1 METHODS RELATED TO BIOACTIVE AGENTS THAT CONVERT FROM ANIONS TO MOLECULES Natural Extraction Systems, LLC (US) 2021-08-12 — — WO claimed
EP-1054871-A2 PYRIMIDINES AND TRIAZINES AS INTEGRIN ANTAGONISTS Du Pont Pharmaceuticals Company (US) 2000-11-29 — — EP claimed
WO-1999067247-A1 PYRAZOLO[1,5-a]TRIAZINE CORTICOTROPIN RELEASING FACTOR ANTAGONISTS DU PONT PHARMACEUTICALS COMPANY (US) 1999-12-29 — — WO claimed
WO-1999050249-A2 PYRIMIDINES AND TRIAZINES AS INTEGRIN ANTAGONISTS DU PONT PHARMACEUTICALS COMPANY (US) 1999-10-07 — — WO claimed
EP-0295880-B1 Substituted cyclic ketones, substituted cyclic enones, and process for producing the same NISSAN CHEMICAL IND LTD (JP) 1999-01-07 — — EP claimed
EP-0255379-B1 Optically active alcohols, process for producing the same, and process for resolving the same NISSAN CHEMICAL IND LTD (JP) 1995-11-15 — — EP claimed
US-5380900-A α-methylenecyclopentanone derivative and process for producing the same NISSAN CHEMICAL INDUSTRIES, LIMITED (JP) 1995-01-10 — — US claimed
US-5041559-A Having epoxy and silyl groups NISSAN CHEMICAL INDUSTRIES, LTD. (JP) 1991-08-20 — — US claimed
US-5037855-A Silane group containing, chemical intermediates NISSAN CHEMICAL INDUSTRIES, LTD. (JP) 1991-08-06 — — US claimed
US-4902812-A Optically active alcohols, process for producing the same, and process for resolving the same NISSAN CHEMICAL INDUSTRIES, LTD. (JP) 1990-02-20 — — US claimed
US-4496745-A Epoxycarbacyclin derivatives, their preparation and use SANKYO COMPANY, LIMITED (JP) 1985-01-29 — — US claimed
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