SCHEMBL5942443

SCHEMBL5942443

COc1ncc(Cl)c(CF)c1CO

nearest known ligand 0.36

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ KCNJ5 P48544 2/20 0.36
▸ KCNJ3 P48549 2/20 0.36
▸ RORC P51449 1/20 0.34
▸ PDXK O00764 1/20 0.32
▸ NUDT1 P36639 1/20 0.31
▸ CCR4 P51679 1/20 0.31

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
SCHEMBL5942806 0.85 KCNJ5 (0.37) KCNJ5KCNJ3RORCPDXKNUDT1
SCHEMBL5942404 0.81 KCNJ5 (0.33) KCNJ5KCNJ3
SCHEMBL5942758 0.81 KCNJ5 (0.39) KCNJ5KCNJ3RORCPDXKNUDT1
SCHEMBL5942288 0.81 KCNJ5 (0.39) KCNJ5KCNJ3RORCPDXKNUDT1
SCHEMBL5942259 0.80 CA2 (0.34) —
SCHEMBL5942304 0.79 KCNJ5 (0.38) KCNJ5KCNJ3RORCPDXKNUDT1
SCHEMBL5942400 0.78 CA2 (0.39) KCNJ5KCNJ3RORCPDXKNUDT1
SCHEMBL5942434 0.78 KCNJ5 (0.35) KCNJ5KCNJ3RORCPDXKNUDT1
SCHEMBL5942207 0.75 KCNJ5 (0.36) KCNJ5KCNJ3PDXKNUDT1CCR4
SCHEMBL5942355 0.74 KCNJ5 (0.38) KCNJ5KCNJ3PDXKNUDT1CCR4

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20060089390-A1 3-benzoyl-2,4,5-substituted pyridine derivatives or salts thereof and bactericides containing the same ISHIHARA SANGYO KAISHA, LTD. (JP) 2006-04-27 — — US claimed
US-20060089390-A1 3-benzoyl-2,4,5-substituted pyridine derivatives or salts thereof and bactericides containing the same ISHIHARA SANGYO KAISHA, LTD. (JP) 2006-04-27 — — US disclosed
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