SCHEMBL3469733

SCHEMBL3469733

N#Cc1nc2c(F)c(F)c(F)cc2[nH]1

nearest known ligand 0.44

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ CBFB Q13951 2/20 0.44
▸ PSMB8 P28062 2/20 0.44
▸ EGLN1 Q9GZT9 1/20 0.39
▸ HRH4 Q9H3N8 1/20 0.37
▸ ALDH1A1 P00352 1/20 0.33
▸ LMNA P02545 1/20 0.33
▸ DHODH Q02127 1/20 0.32

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
SCHEMBL31748611 0.85 PSMB8 (0.41) CBFBPSMB8EGLN1DHODH
SCHEMBL5904354 0.74 PSMB8 (0.54) CBFBPSMB8EGLN1HRH4ALDH1A1
SCHEMBL3469735 0.71 PSMB8 (0.40) PSMB8
SCHEMBL9172104 0.67 CACNA1H (0.56) EGLN1
SCHEMBL9391888 0.66 RIPK1 (0.53) CBFBPSMB8EGLN1
SCHEMBL23449132 0.66 PSMB8 (0.41) PSMB8
SCHEMBL1832199 0.64 PSMB8 (0.65) CBFBPSMB8
SCHEMBL251067 0.62 PSMB8 (0.67) PSMB8
SCHEMBL20094244 0.62 CBFB (0.51) CBFBEGLN1HRH4ALDH1A1
SCHEMBL1192621 0.62 EGLN1 (0.54) CBFBEGLN1HRH4ALDH1A1LMNA

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-2010069519-A1 TOPICAL COMPOSITIONS COMPRISING AT LEAST ONE ACTIVE INGREDIENT POORLY SOLUBLE IN WATER AND BIOPOLYMERS SUCH AS HYALURONIC ACID WITH A PKA-VALUE BETWEEN 5-7 MERZ PHARMA GMBH & CO. KGAA (DE) 2010-06-24 — — WO disclosed
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