SCHEMBL22781102

SCHEMBL22781102

CC(C)c1cccc2c3ccccc3n(-c3nccn3C(C)C)c12

nearest known ligand 0.35

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ KMT2A Q03164 1/20 0.32
▸ ALDH1A1 P00352 1/20 0.32
▸ MAPT P10636 1/20 0.32
▸ AGER Q15109 1/20 0.32
▸ DUSP3 P51452 1/20 0.32
▸ ALKBH5 Q6P6C2 1/20 0.31
▸ FTO Q9C0B1 1/20 0.31
▸ PDE4A P27815 1/20 0.31
▸ PDE4B Q07343 1/20 0.31
▸ PDE4C Q08493 1/20 0.31
▸ PDE4D Q08499 1/20 0.31

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
SCHEMBL22781173 0.86 ALDH1A1 (0.32) ALDH1A1MAPTAGERDUSP3ALKBH5
SCHEMBL26002666 0.77 ALKBH5 (0.33) DUSP3ALKBH5FTO
SCHEMBL26828704 0.76 MAOA (0.43) ALDH1A1MAPTAGER
SCHEMBL20624839 0.73 KDM4E (0.55) KMT2AALDH1A1MAPTDUSP3ALKBH5
SCHEMBL30154869 0.72 MAT2A (0.41) MAPTPDE4APDE4BPDE4CPDE4D
SCHEMBL26002654 0.70 NQO2 (0.37) ALDH1A1MAPTDUSP3ALKBH5FTO
SCHEMBL16640352 0.70 BCHE (0.43) KMT2AALDH1A1MAPTALKBH5FTO
SCHEMBL26002677 0.68 BCHE (0.35) KMT2AMAPTDUSP3ALKBH5FTO
SCHEMBL16133319 0.68 ALKBH5 (0.51) KMT2AALDH1A1MAPTAGERDUSP3
SCHEMBL26002664 0.68 KDM4E (0.40) ALKBH5FTO

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-3750897-A1 ORGANIC ELECTROLUMINESCENT MATERIALS AND DEVICES Universal Display Corporation (US) 2020-12-16 — — EP disclosed
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