SCHEMBL5072097

SCHEMBL5072097

CN(C)c1ccc(-c2cc3[nH]ccnc-3n2)cc1CCCO

nearest known ligand 0.33

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ SYK P43405 3/20 0.33
▸ CTSS P25774 1/20 0.32
▸ CTSK P43235 1/20 0.32
▸ KCNH2 Q12809 1/20 0.31
▸ AURKB Q96GD4 1/20 0.31
▸ VCP P55072 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
SCHEMBL1777955 0.71 CCNB2 (0.54) —
SCHEMBL7402425 0.62 POLB (0.34) —
SCHEMBL8676051 0.60 GAA (0.39) —
SCHEMBL12650917 0.60 EGFR (0.30) —
SCHEMBL30966776 0.60 RXRA (0.39) —
SCHEMBL14733919 0.58 BCHE (0.42) —
SCHEMBL28796038 0.57 BCHE (0.40) —
SCHEMBL9315 0.57 — —
SCHEMBL9912056 0.56 TAAR1 (0.37) KCNH2
SCHEMBL23144903 0.56 CXCR4 (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
EP-1990343-A2 Azaindoles Aventis Pharma Limited (GB) 2008-11-12 — — EP disclosed
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