SCHEMBL2436484

SCHEMBL2436484

C=CCCl.CC(C)Cc1cccc(OC(C)OC(C)NC(C)(C)c2ccccc2)c1CC(C)C

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
SCHEMBL25267340 0.92 GABRA1 (0.31)
Hydrochloric Acid SCHEMBL1858922 0.91 GABRA1 (0.31)
Hydrochloric Acid SCHEMBL11607442 0.90 GABRA1 (0.30)
SCHEMBL1013751 0.83 GABRA1 (0.34)
Hydrochloric Acid SCHEMBL7748984 0.82 SLC6A2 (0.32)
Hydrochloric Acid SCHEMBL512162 0.82 GABRA1 (0.33)
Hydrochloric Acid SCHEMBL11594213 0.76 GABRA1 (0.32)
Hydrochloric Acid SCHEMBL5029119 0.72 SLC6A2 (0.34)
Hydrochloric Acid SCHEMBL4452872 0.71 L3MBTL1 (0.30)
SCHEMBL7076726 0.71 GABRA1 (0.40)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8409322-B2 Method for agglomerating industrial dust, in particular using a briquetting technique S.P.C.M. SA (FR) 2013-04-02 US disclosed
US-20110209582-A1 METHOD FOR AGGLOMERATING INDUSTRIAL DUST, IN PARTICULAR USING A BRIQUETTING TECHNIQUE S.P.C.M. SA (FR) 2011-09-01 US disclosed