SCHEMBL22781173

SCHEMBL22781173

CC(C)n1ccnc1-n1c2ccccc2c2cccc(S)c21

nearest known ligand 0.35

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ 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 0.32
▸ FTO Q9C0B1 1/20 0.32
▸ PDE4A P27815 1/20 0.32
▸ PDE4B Q07343 1/20 0.32
▸ PDE4C Q08493 1/20 0.32
▸ PDE4D Q08499 1/20 0.32
▸ PSMD14 O00487 1/20 0.31
▸ COPS5 Q92905 1/20 0.31
▸ KDM4E B2RXH2 1/20 0.30
▸ ATM Q13315 1/20 0.30
▸ L3MBTL1 Q9Y468 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
SCHEMBL22781102 0.86 KMT2A (0.32) ALDH1A1MAPTAGERDUSP3ALKBH5
SCHEMBL26828704 0.77 MAOA (0.43) ALDH1A1MAPTAGER
SCHEMBL30154869 0.73 MAT2A (0.41) MAPTPDE4APDE4BPDE4CPDE4D
SCHEMBL20019484 0.69 L3MBTL1 (0.61) ALDH1A1MAPTDUSP3ALKBH5FTO
SCHEMBL16133319 0.69 ALKBH5 (0.51) ALDH1A1MAPTAGERDUSP3ALKBH5
SCHEMBL22781174 0.67 ALKBH5 (0.49) ALDH1A1MAPTAGERDUSP3ALKBH5
SCHEMBL22781099 0.66 ALKBH5 (0.48) ALDH1A1MAPTAGERDUSP3ALKBH5
SCHEMBL17463116 0.66 GPR3 (0.43) ALDH1A1MAPTAGERKDM4EATM
SCHEMBL29709990 0.63 KDM4E (0.45) ALDH1A1MAPTDUSP3ALKBH5FTO
SCHEMBL26002666 0.62 ALKBH5 (0.33) DUSP3ALKBH5FTOKDM4EATM

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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