SCHEMBL29019883

SCHEMBL29019883

CCOC(=O)C(CC)CCC(C)OC

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA1 P00915 1/20 0.44
CA2 P00918 1/20 0.44
CPB2 Q96IY4 2/20 0.38
MEN1 O00255 2/20 0.35
KMT2A Q03164 2/20 0.35
NPC1 O15118 1/20 0.35
ALDH1A1 P00352 2/20 0.34
EPHX2 P34913 3/20 0.33
LMNA P02545 1/20 0.33
HSD17B10 Q99714 1/20 0.33
PPARG P37231 2/20 0.33
ALOX15 P16050 1/20 0.32
MGAM O43451 1/20 0.32
GAA P10253 1/20 0.32
SI P14410 1/20 0.32
MGAM2 Q2M2H8 1/20 0.32
SOAT1 P35610 1/20 0.32
TDP1 Q9NUW8 1/20 0.32
RAB9A P51151 1/20 0.32
L3MBTL1 Q9Y468 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
SCHEMBL29108049 0.86 CA2 (0.60) CA1CA2KMT2A
SCHEMBL21052387 0.85 CA2 (0.50) CA1CA2CPB2MEN1KMT2A
SCHEMBL157396 0.80 CA2 (0.52) CA1CA2TDP1
SCHEMBL10073517 0.80 CA1 (0.42) CA1CA2CPB2MEN1KMT2A
SCHEMBL29134102 0.78 CA1 (0.38) CA1CA2
SCHEMBL13575662 0.77 CA2 (0.52) CA1CA2CPB2MEN1KMT2A
SCHEMBL17617131 0.77 CA2 (0.52) CA1CA2CPB2MEN1KMT2A
SCHEMBL5679114 0.77 CA2 (0.52) CA1CA2CPB2MEN1KMT2A
SCHEMBL284647 0.76 ALDH1A1 (0.50) CA1CA2CPB2MEN1KMT2A
SCHEMBL20704277 0.75 CA2 (0.45) CA1CA2CPB2MEN1KMT2A

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-113795521-B Colored curable resin composition 住友化学株式会社 2023-05-12 CN disclosed