SCHEMBL13041519

SCHEMBL13041519

CCc1sc(-c2c(C)cc(Cl)cc2F)nc1C1C(=O)C(C)(C)OC(C)(C)C1=O

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
SCHEMBL13041476 0.83 GRM2 (0.35) —
SCHEMBL13041511 0.82 GLA (0.36) —
SCHEMBL13041477 0.81 PTPN11 (0.35) —
SCHEMBL2762937 0.80 HRH3 (0.41) —
SCHEMBL10237993 0.79 — —
SCHEMBL13058533 0.79 L3MBTL1 (0.30) —
SCHEMBL13041546 0.78 DCK (0.42) —
SCHEMBL13041555 0.77 GRM2 (0.34) —
SCHEMBL13041491 0.77 KDM4E (0.40) —
SCHEMBL13041543 0.75 L3MBTL1 (0.44) —

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8956999-B2 Herbicides SYNGENTA LIMITED (GB) 2015-02-17 — — US disclosed
US-8956999-B2 Herbicides SYNGENTA LIMITED (GB) 2015-02-17 — — US disclosed
US-20100279868-A1 NOVEL HERBICIDES SYNGENTA CROP PROTECTION, INC. (US) 2010-11-04 — — US disclosed
US-20100279868-A1 NOVEL HERBICIDES SYNGENTA CROP PROTECTION, INC. (US) 2010-11-04 — — US disclosed
WO-2009000533-A1 NOVEL HERBICIDES SYNGENTA LIMITED (GB) 2008-12-31 — — WO disclosed
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