SCHEMBL3225306

SCHEMBL3225306

N#CC(C#N)(CCC(F)(F)F)C(F)C(F)(F)C(F)(F)C(F)C(F)F

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
SCHEMBL5051769 0.89
SCHEMBL4618551 0.89
SCHEMBL5137908 0.78
SCHEMBL5137802 0.76
SCHEMBL5138672 0.74
SCHEMBL4638368 0.71
SCHEMBL4616725 0.69
SCHEMBL4617764 0.68
SCHEMBL4619790 0.67
SCHEMBL4619134 0.64

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-20100041552-A1 Crystalline Modification of Fipronil BASF SE (DE) 2010-02-18 US disclosed
EP-1893020-A1 DERIVATIVES OF A 1-PHENYLTRIAZOLE AS ANTIPARASITIC AGENTS BASF SE (DE) 2008-03-05 EP disclosed
EP-1890544-A2 COMPOSITION FOR THE IMPREGNATION OF FIBERS, FABRICS AND NETTINGS IMPARTING A PROTECTIVE ACTIVITY AGAINST PESTS BASF AKTIENGESELLSCHAFT (DE) 2008-02-27 EP disclosed
WO-2006128870-A2 COMPOSITION FOR THE IMPREGNATION OF FIBERS, FABRICS AND NETTINGS IMPARTING A PROTECTIVE ACTIVITY AGAINST PESTS BASF AKTIENGESELLSCHAFT (DE) 2006-12-07 WO disclosed
WO-2006128867-A1 DERIVATIVES OF A 1-PHENYLTRIAZOLE AS ANTIPARASITIC AGENTS BASF AKTIENGESELLSCHAFT (DE) 2006-12-07 WO disclosed