SCHEMBL10972776

SCHEMBL10972776

CCOC(=O)c1c(C)cc2nc(CO)n(-c3ccccc3C(F)(F)F)c(=O)c2c1C

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CNR1 P21554 1/20 0.54
▸ CNR2 P34972 1/20 0.54
▸ ALDH1A1 P00352 4/20 0.40
▸ L3MBTL1 Q9Y468 2/20 0.40
▸ ADORA1 P30542 1/20 0.39
▸ PDE1A P54750 1/20 0.39
▸ PDE1B Q01064 1/20 0.39
▸ PDE3B Q13370 1/20 0.39
▸ PDE1C Q14123 1/20 0.39
▸ PDE3A Q14432 1/20 0.39
▸ THRB P10828 1/20 0.38
▸ SLC5A1 P13866 1/20 0.38
▸ SLC5A2 P31639 1/20 0.38
▸ KDM4E B2RXH2 2/20 0.38
▸ APLNR P35414 1/20 0.38
▸ LMNA P02545 4/20 0.37
▸ KMT2A Q03164 4/20 0.37
▸ MEN1 O00255 3/20 0.37
▸ POLB P06746 1/20 0.37
▸ HCAR1 Q9BXC0 1/20 0.36

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
SCHEMBL11340568 0.97 CNR1 (0.52) CNR1CNR2ALDH1A1L3MBTL1ADORA1
SCHEMBL10977927 0.90 ALDH1A1 (0.52) CNR1CNR2ALDH1A1L3MBTL1ADORA1
SCHEMBL10973770 0.90 CNR1 (0.56) CNR1CNR2ALDH1A1L3MBTL1THRB
SCHEMBL11071848 0.89 CNR1 (0.57) CNR1CNR2ALDH1A1L3MBTL1ADORA1
SCHEMBL11081687 0.89 CNR1 (0.59) CNR1CNR2ALDH1A1ADORA1PDE1A
SCHEMBL10980011 0.87 CNR1 (0.53) CNR1CNR2ALDH1A1L3MBTL1THRB
SCHEMBL11070514 0.86 CNR1 (0.57) CNR1CNR2ALDH1A1ADORA1PDE1A
SCHEMBL10973972 0.86 CNR1 (0.57) CNR1CNR2ALDH1A1ADORA1PDE1A
SCHEMBL11079598 0.85 CNR1 (0.56) CNR1CNR2ALDH1A1L3MBTL1ADORA1
SCHEMBL11074709 0.85 CNR1 (0.56) CNR1CNR2ALDH1A1L3MBTL1ADORA1

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
EP-0056637-B1 4(3H)-QUINAZOLINONE DERIVATIVES, PROCESS FOR PRODUCTION THEREOF AND PHARMACEUTICAL COMPOSITIONS COMPRISING SAID COMPOUNDS Ishikawa, Masayuki (JP) 1985-07-24 — — EP disclosed
US-4451467-A HYPOTENSIVE AGENTS Ishikawa, Masayuki (JP) 1984-05-29 — — US disclosed
EP-0056637-A1 4(3H)-quinazolinone derivatives, process for production thereof and pharmaceutical compositions comprising said compounds Ishikawa, Masayuki (JP) 1982-07-28 — — EP disclosed
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