SCHEMBL13890918

SCHEMBL13890918

CC(C)(C=CC(C)(C)c1c(O)n(-c2ccccc2)n(-c2ccccc2)c1=O)C=C1C(=O)N(c2ccccc2)N(c2ccccc2)C1=O

nearest known ligand 0.36

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 2/20 0.34
▸ ALOX15 P16050 1/20 0.34
▸ GAA P10253 2/20 0.32
▸ LMNA P02545 1/20 0.32
▸ KMT2A Q03164 3/20 0.32
▸ MAPT P10636 2/20 0.32
▸ MAOB P27338 1/20 0.32
▸ MEN1 O00255 1/20 0.31
▸ NR1H4 Q96RI1 2/20 0.31
▸ L3MBTL1 Q9Y468 1/20 0.30
▸ SMN1; SMN2 Q16637 2/20 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
SCHEMBL13890920 0.78 CYP3A4 (0.39) ALDH1A1GAALMNAMAPTMAOB
SCHEMBL12511897 0.72 MAPT (0.47) ALDH1A1ALOX15GAALMNAKMT2A
SCHEMBL12216648 0.68 ALDH1A1 (0.40) ALDH1A1ALOX15GAALMNAKMT2A
SCHEMBL13019509 0.68 ALDH1A1 (0.39) ALDH1A1ALOX15LMNAKMT2AMAPT
SCHEMBL12216645 0.66 ALDH1A1 (0.38) ALDH1A1ALOX15GAALMNAKMT2A
SCHEMBL12715299 0.66 ALDH1A1 (0.38) ALDH1A1ALOX15GAALMNAKMT2A
SCHEMBL12511299 0.63 ALDH1A1 (0.53) ALDH1A1ALOX15LMNAKMT2AMAPT
SCHEMBL13966824 0.63 ALDH1A1 (0.49) ALDH1A1ALOX15KMT2AMAPTMEN1
SCHEMBL13716111 0.63 NR1H4 (0.44) ALDH1A1GAALMNAKMT2AMEN1
SCHEMBL13966825 0.63 NR1H4 (0.44) ALDH1A1GAALMNAKMT2AMAPT

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-2051249-A1 Holgraphic recording and reading method and holographic recording and reading apparatus Fujifilm Corporation (JP) 2009-04-22 — — EP disclosed
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