SCHEMBL3861308

SCHEMBL3861308

C[C](C)CCCCBr

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
SCHEMBL8117281 0.97 TSHR (0.37) —
SCHEMBL27949630 0.97 — —
SCHEMBL3447447 0.89 — —
SCHEMBL3287225 0.84 ALDH1A1 (0.33) —
SCHEMBL11304871 0.81 PAOX (0.38) —
SCHEMBL1166877 0.78 — —
SCHEMBL6580621 0.78 — —
SCHEMBL7875848 0.77 — —
SCHEMBL2933239 0.76 — —
SCHEMBL23297342 0.76 TSHR (0.32) —

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
US-20230089351-A1 METHODS RELATED TO BIOACTIVE AGENTS THAT CONVERT FROM ANIONS TO MOLECULES Natural Extraction Systems, LLC (US) 2023-03-23 — — 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
WO-2021158575-A1 COMPOSITIONS RELATED TO BIOACTIVE AGENTS THAT CONVERT FROM ANIONS TO MOLECULES Natural Extraction Systems, LLC (US) 2021-08-12 — — WO claimed
EP-1802293-A4 ORALLY EFFECTIVE CANNABINOID ANALOGS PHARMOS CORP (US) 2009-04-29 — — EP claimed
US-20090068143-A1 ORALLY EFFECTIVE CANNABINOID ANALOGS PHARMOS CORPORATION (US) 2009-03-12 — — US claimed
EP-1802293-A2 ORALLY EFFECTIVE CANNABINOID ANALOGS PHARMOS CORPORATION (US) 2007-07-04 — — EP claimed
WO-2006043260-A2 ORALLY EFFECTIVE CANNABINOID ANALOGS PHARMOS CORPORATION (US) 2006-04-27 — — WO claimed
US-20050020544-A1 Bicyclic CB2 cannabinoid receptor ligands PHARMOS CORPORATION 2005-01-27 — — US claimed
US-20230089351-A1 METHODS RELATED TO BIOACTIVE AGENTS THAT CONVERT FROM ANIONS TO MOLECULES Natural Extraction Systems, LLC (US) 2023-03-23 — — US disclosed
WO-2021158573-A1 METHODS RELATED TO BIOACTIVE AGENTS THAT CONVERT FROM ANIONS TO MOLECULES Natural Extraction Systems, LLC (US) 2021-08-12 — — WO disclosed
WO-2021158575-A1 COMPOSITIONS RELATED TO BIOACTIVE AGENTS THAT CONVERT FROM ANIONS TO MOLECULES Natural Extraction Systems, LLC (US) 2021-08-12 — — WO disclosed
CN-102224452-B Diamine, polyimide, liquid crystal aligning agent, and liquid crystal alignment film NISSAN CHEMICAL IND LTD 2014-07-09 — — CN disclosed
CN-103619817-A Novel bicyclic nitrogen containing heteroaryl TGR5 receptor modulators BRISTOL MYERS SQUIBB CO 2014-03-05 — — CN disclosed
EP-1802293-A4 ORALLY EFFECTIVE CANNABINOID ANALOGS PHARMOS CORP (US) 2009-04-29 — — EP disclosed
US-20090068143-A1 ORALLY EFFECTIVE CANNABINOID ANALOGS PHARMOS CORPORATION (US) 2009-03-12 — — US disclosed
EP-1802293-A2 ORALLY EFFECTIVE CANNABINOID ANALOGS PHARMOS CORPORATION (US) 2007-07-04 — — EP disclosed
WO-2006043260-A2 ORALLY EFFECTIVE CANNABINOID ANALOGS PHARMOS CORPORATION (US) 2006-04-27 — — WO disclosed
US-20050020544-A1 Bicyclic CB2 cannabinoid receptor ligands PHARMOS CORPORATION 2005-01-27 — — US disclosed
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