SCHEMBL28869726

SCHEMBL28869726

NN(C(=O)Cl)c1ccccc1C(F)F

nearest known ligand 0.33

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
AOC3 Q16853 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
SCHEMBL28595013 0.71 LMNA (0.40)
SCHEMBL465753 0.67 ALDH1A1 (0.54)
SCHEMBL28609721 0.66 NPSR1 (0.52)
SCHEMBL20686674 0.66 GAA (0.32)
SCHEMBL22564257 0.65
SCHEMBL22563787 0.65 GAA (0.31)
SCHEMBL5134567 0.63 KDM4E (0.50)
SCHEMBL1538924 0.63 GABRA1 (0.35)
SCHEMBL27873162 0.62 LMNA (0.38)
SCHEMBL30545019 0.61 ESR1 (0.32)

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
CN-114195716-A N1-aryl-3-fluoroalkyl-4-cyanopyrazole compound, preparation method and application 天津大学 2022-03-18 CN disclosed