SCHEMBL20076496

SCHEMBL20076496

C=C(C)c1cc(N)cc(F)c1CC

nearest known ligand 0.30

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
TBK1 Q9UHD2 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
SCHEMBL20076500 0.80 NOS3 (0.32)
SCHEMBL20149228 0.78 TAAR1 (0.35)
SCHEMBL20076889 0.77 IKBKE (0.33) TBK1
SCHEMBL20076491 0.76 KDM4E (0.37) TBK1
SCHEMBL26462734 0.71 KLKB1 (0.33)
SCHEMBL21736856 0.71 NOS3 (0.35)
SCHEMBL23864570 0.69 ALDH1A1 (0.35) TBK1
SCHEMBL10158627 0.69 CRBN (0.38) TBK1
SCHEMBL38657971 0.69 CRBN (0.38) TBK1
SCHEMBL10228073 0.69 CYP3A4 (0.41)

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