SCHEMBL10658258

SCHEMBL10658258

O=c1c2c(c3ncccc3n1-c1ccc(Cl)cc1)OCC2

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
USP14 P54578 2/20 0.41
MAPT P10636 2/20 0.37
HPGD P15428 1/20 0.37
EP300 Q09472 1/20 0.37
CREBBP Q92793 1/20 0.37
KAT2A Q92830 1/20 0.37
KAT2B Q92831 1/20 0.37
PDE4A P27815 7/20 0.36
ADORA2B P29275 2/20 0.35
ADORA3 P0DMS8 1/20 0.35
ADORA2A P29274 1/20 0.35
PDE4B Q07343 3/20 0.34
PDE4D Q08499 2/20 0.34
ADORA1 P30542 1/20 0.34
POLB P06746 1/20 0.33
MEN1 O00255 1/20 0.32
USP2 O75604 1/20 0.32
ALDH1A1 P00352 1/20 0.32
CYP1A2 P05177 1/20 0.32
CYP2C9 P11712 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
SCHEMBL10657180 0.89 REN (0.36) KAT2BPDE4APDE4BPDE4DALDH1A1
SCHEMBL10660843 0.88 MAPT (0.39) MAPTHPGDPDE4APDE4BPDE4D
SCHEMBL10659547 0.88 ALDH1A1 (0.41) USP14MAPTHPGDKAT2BPDE4A
SCHEMBL10658485 0.88 HPGD (0.37) MAPTHPGDEP300CREBBPKAT2A
SCHEMBL10659134 0.87 KAT2B (0.40) MAPTEP300CREBBPKAT2AKAT2B
SCHEMBL10654535 0.85 PKM (0.42) MAPTKAT2BPDE4AADORA3PDE4B
SCHEMBL10377461 0.84 MAPT (0.35) MAPTHPGDPDE4APDE4BPDE4D
SCHEMBL9629050 0.82 HPGD (0.47) MAPTHPGDEP300CREBBPKAT2A
SCHEMBL10657014 0.80 GAA (0.36) HPGDEP300KAT2BPDE4APOLB
SCHEMBL10657544 0.78 EPHB4 (0.44) MAPTKAT2BPDE4AADORA2APDE4B

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4740511-A ANTIALLERGENS, ANTIINFLAMMATORY, ANTIULCER AGENTS SCHERING CORPORATION (US) 1988-04-26 US disclosed
US-4680297-A Tricyclic positive inotropic agents SCHERING CORPORATION (US) 1987-07-14 US disclosed
EP-0127135-A2 Fused tricyclic derivatives of naphthyridinone and pyridone and the corresponding thiones SCHERING CORPORATION (US) 1984-12-05 EP disclosed