SCHEMBL7526285

SCHEMBL7526285

CCCCCCCCCCCCCCCCCCN1C(C)(C)CC(OC(=O)O)CC1(C)C

nearest known ligand 0.36

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
NAAA Q02083 2/20 0.36
BCHE P06276 1/20 0.35
CHRM3 P20309 6/20 0.33
TSHR P16473 2/20 0.33
KMT2A Q03164 1/20 0.33
KCNH2 Q12809 1/20 0.33
ALDH1A1 P00352 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
SCHEMBL9137958 1.00 NAAA (0.36) NAAABCHECHRM3TSHRKMT2A
SCHEMBL7526280 0.89 NAAA (0.37) NAAABCHECHRM3ALDH1A1
SCHEMBL15966882 0.89 NAAA (0.37) NAAABCHECHRM3ALDH1A1
SCHEMBL9137952 0.89 NAAA (0.37) NAAABCHECHRM3ALDH1A1
SCHEMBL19823422 0.88 KMT2A (0.41) NAAACHRM3TSHRKMT2AALDH1A1
SCHEMBL11396874 0.87 NAAA (0.42) NAAABCHECHRM3KMT2AALDH1A1
SCHEMBL11828465 0.87 NAAA (0.49) NAAAKMT2A
SCHEMBL17296567 0.85 NAAA (0.55) NAAA
SCHEMBL890535 0.85 NAAA (0.55) NAAA
SCHEMBL16135402 0.85 NAAA (0.55) NAAA

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-20020174491-A1 Process for stabilizing the whiteness of lignin-containing fibrous materials, stabilizer composition and fibrous materials stabilized with this DEGUSSA-AG (DE) 2002-11-28 US disclosed