SCHEMBL8621952

SCHEMBL8621952

CC(CC(C)(C)CO)C(N)=O

nearest known ligand 0.37

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
CA1 P00915 1/20 0.30
CA2 P00918 1/20 0.30

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
SCHEMBL15672770 0.82 CA1 (0.34) CA1CA2
SCHEMBL28684992 0.79 GABRR1 (0.39)
SCHEMBL25211578 0.79 GABRR1 (0.34) CA1CA2
SCHEMBL12867359 0.78 CA1 (0.33) CA1CA2
SCHEMBL8963 0.78 CA1 (0.33) CA1CA2
SCHEMBL10164157 0.78 CA1 (0.33) CA1CA2
SCHEMBL7173651 0.77 FDPS (0.30)
SCHEMBL14321927 0.76 PIK3CD (0.34) CA1CA2
SCHEMBL25098364 0.74 CA1 (0.31) CA1CA2
SCHEMBL20154129 0.74 ALDH1A1 (0.34) CA1CA2

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-5725604-A Thermofixing of dyes in presence of polymerizable compound and an initiator CIBA SPECIALTY CHEMICALS CORPORATION (US) 1998-03-10 US disclosed