SCHEMBL31474548

SCHEMBL31474548

CC(C)OC(C)C.CCC(=O)CC(=O)[O-].CCC(=O)CC(=O)[O-].CCC(=O)CC(=O)[O-].[Al+3]

nearest known ligand 0.40

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
CA4 P22748 2/20 0.36
TDP1 Q9NUW8 1/20 0.36
CA2 P00918 1/20 0.33
CA1 P00915 2/20 0.32
FFAR3 O14843 2/20 0.31
HDAC3 O15379 2/20 0.31
HDAC1 Q13547 2/20 0.31
HDAC2 Q92769 2/20 0.31
HDAC8 Q9BY41 2/20 0.31
MEN1 O00255 1/20 0.30
CYP2C19 P33261 1/20 0.30
RECQL P46063 1/20 0.30
KMT2A Q03164 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
SCHEMBL1361565 0.85 CA4 (0.38) CA4TDP1CA2CA1FFAR3
SCHEMBL28256632 0.85 CA4 (0.41) CA4TDP1CA2CA1FFAR3
SCHEMBL422281 0.85 CA4 (0.41) CA4TDP1CA2CA1FFAR3
SCHEMBL3802494 0.84 CA4 (0.50) CA4TDP1CA2CA1FFAR3
SCHEMBL29017476 0.84 HDAC3 (0.43) CA4CA2CA1FFAR3HDAC3
SCHEMBL17433606 0.83 CA4 (0.36) CA4TDP1CA2CA1FFAR3
SCHEMBL17477080 0.83 CA4 (0.36) CA4TDP1CA2CA1FFAR3
SCHEMBL8700120 0.83 CA4 (0.36) CA4TDP1CA2CA1FFAR3
SCHEMBL9332540 0.82 CA4 (0.47) CA4TDP1CA2CA1FFAR3
SCHEMBL6230690 0.81 CA2 (0.39) CA4TDP1CA2CA1FFAR3

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
CN-119404118-A Light absorber, light-absorbing compound, dispersion of light-absorbing compound, light-absorbing composition, optical filter, photoelectric conversion element, ambient light sensor, and imaging device 日本板硝子株式会社 2025-02-07 CN disclosed