SCHEMBL8429490

SCHEMBL8429490

Cn1nc(-c2cc(C#N)c(Cl)cc2F)c(Cl)c1OC(F)F

nearest known ligand 0.31

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
AR P10275 1/20 0.31
ALDH1A1 P00352 1/20 0.31
CNR1 P21554 1/20 0.30
CNR2 P34972 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
SCHEMBL8296745 0.95 ALDH1A1 (0.33) ARALDH1A1
SCHEMBL7162190 0.89 EGLN2 (0.33)
SCHEMBL8299245 0.86 AR (0.30) AR
SCHEMBL8298154 0.86 KHK (0.34)
SCHEMBL8296926 0.84
SCHEMBL7160104 0.83 SLC34A1 (0.32)
SCHEMBL8296721 0.83
SCHEMBL6289042 0.82 SCN9A (0.35)
SCHEMBL8428795 0.82 PRKDC (0.31)
SCHEMBL4156778 0.82

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
US-5962694-A Substituted 1-methyl-3-phenylpyrazoles and the use thereof as herbicides and for the desiccation or defoliation of plants BASF AKTIENGESELLSCHAFT (DE) 1999-10-05 US disclosed