SCHEMBL10658802

SCHEMBL10658802

CC1Cc2c(n(Cc3ccccc3)c3ncccc3c2=O)O1

nearest known ligand 0.45

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
PTGDR2 Q9Y5Y4 3/20 0.45
MEN1 O00255 1/20 0.43
KMT2A Q03164 1/20 0.43
CNR1 P21554 3/20 0.41
CNR2 P34972 3/20 0.41
PDE4A P27815 2/20 0.41
PDE4B Q07343 2/20 0.41
PDE4C Q08493 2/20 0.41
PDE4D Q08499 2/20 0.41
ENPP2 Q13822 4/20 0.40
L3MBTL1 Q9Y468 1/20 0.40
RXFP1 Q9HBX9 1/20 0.39
THRB P10828 1/20 0.39

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
SCHEMBL10656830 0.89 PLK1 (0.42) PTGDR2MEN1KMT2APDE4APDE4B
SCHEMBL10658199 0.82 P2RX4 (0.55) MEN1KMT2AL3MBTL1
SCHEMBL10657751 0.82 CNR1 (0.46) PTGDR2MEN1KMT2ACNR1CNR2
SCHEMBL9629995 0.81 FEN1 (0.44) PDE4APDE4BPDE4CPDE4D
SCHEMBL10659571 0.78 PTGDR2 (0.45) PTGDR2MEN1KMT2ACNR1CNR2
SCHEMBL10657054 0.76 ENPP2 (0.43) PTGDR2MEN1KMT2ACNR1CNR2
SCHEMBL9630915 0.76 HPGD (0.38) MEN1KMT2APDE4APDE4BPDE4D
SCHEMBL10378796 0.76 HPGD (0.44) MEN1KMT2APDE4APDE4BPDE4C
SCHEMBL10658218 0.74 DHFR (0.44) MEN1KMT2AL3MBTL1THRB
SCHEMBL9629150 0.74 MAPT (0.46) MEN1KMT2APDE4APDE4BPDE4D

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 4 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-4680298-A Tricyclic anti-allergy and use as anti-inflammatory agents SCHERING CORPORATION (US) 1987-07-14 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