SCHEMBL20076867

SCHEMBL20076867

C=C(CCCN)NCCC(F)(F)F

nearest known ligand 0.33

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
HDAC6 Q9UBN7 1/20 0.33

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
SCHEMBL20045682 0.77 CA1 (0.41) HDAC6
Hydrochloric Acid SCHEMBL28316799 0.76 CA1 (0.43) HDAC6
SCHEMBL23607690 0.72 SLC6A5 (0.39)
SCHEMBL20255427 0.69
SCHEMBL20045681 0.68 CYP3A4 (0.39) HDAC6
Hydrochloric Acid SCHEMBL28317773 0.67 LMNA (0.41) HDAC6
SCHEMBL19823328 0.66 TDP1 (0.44)
SCHEMBL27005541 0.65 SLC6A5 (0.47)
SCHEMBL14209341 0.65 PAOX (0.42)
SCHEMBL23060062 0.65 CA12 (0.56) HDAC6

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
WO-2018071327-A1 MOLECULES HAVING PESTICIDAL UTILITY, AND INTERMEDIATES, COMPOSITIONS, AND PROCESSES, RELATED THERETO DOW AGROSCIENCES LLC (US) 2018-04-19 WO disclosed