SCHEMBL21021677

SCHEMBL21021677

CCCC(/C=C/c1cc(C)c(Cl)c(Cl)c1)CCC

nearest known ligand 0.30

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
PTGS1 P23219 2/20 0.30
PTGS2 P35354 2/20 0.30
ALOX5 P09917 1/20 0.30

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
SCHEMBL20076868 0.90 ALDH1A1 (0.30)
SCHEMBL21021651 0.83
SCHEMBL21021438 0.77 CHAT (0.44) PTGS2
SCHEMBL18163169 0.76
SCHEMBL21021004 0.75 ALDH3A1 (0.31)
SCHEMBL20076856 0.73 TRPA1 (0.43)
SCHEMBL20144645 0.71 RAPGEF4 (0.38) PTGS1PTGS2ALOX5
SCHEMBL21021185 0.69 PTGS1 (0.63) PTGS1PTGS2ALOX5
SCHEMBL21022363 0.66 RAF1 (0.32)
SCHEMBL23464454 0.65 ALDH1A1 (0.46)

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-3283459-B1 MOLECULES HAVING PESTICIDAL UTILITY, AND INTERMEDIATES, COMPOSITIONS, AND PROCESSES, RELATED THERETO DOW AGROSCIENCES LLC (US) 2019-05-22 EP disclosed