SCHEMBL21022344

SCHEMBL21022344

CCc1cc(C#N)cc(C2C(C=O)C2(Cl)Cl)c1

nearest known ligand 0.36

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
CYP2A6 P11509 1/20 0.36

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

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
SCHEMBL21586821 0.82 SLC9A1 (0.35)
SCHEMBL21022280 0.80 FFAR4 (0.36) CYP2A6
SCHEMBL18143648 0.78 FADS1 (0.34)
SCHEMBL18143647 0.78 FADS1 (0.34)
SCHEMBL18143649 0.78 FADS1 (0.34)
SCHEMBL2607125 0.71 CYP2A6 (0.58) CYP2A6
SCHEMBL5199687 0.71 CYP2A6 (0.58) CYP2A6
SCHEMBL21019498 0.70
SCHEMBL18147887 0.67 SLC9A1 (0.39)
SCHEMBL18144047 0.67 SLC9A1 (0.39)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3283460-B1 MOLECULES HAVING PESTICIDAL UTILITY, AND INTERMEDIATES, COMPOSITION, AND PROCESSES, RELATED THERETO DOW AGROSCIENCES LLC (US) 2019-05-22 EP disclosed