SCHEMBL10977573

SCHEMBL10977573

CCOC(=O)c1c(C)cc2nc(COC(=O)Oc3ccccc3)n(-c3ccccc3Cl)c(=O)c2c1C

nearest known ligand 0.55

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ CNR1 P21554 1/20 0.55
▸ CNR2 P34972 1/20 0.55
▸ PDE4B Q07343 3/20 0.40
▸ PDE4A P27815 2/20 0.40
▸ PDE4C Q08493 2/20 0.40
▸ PDE4D Q08499 2/20 0.40
▸ TP53 P04637 3/20 0.38
▸ THRB P10828 1/20 0.38
▸ MAPT P10636 1/20 0.37
▸ ALDH1A1 P00352 2/20 0.37
▸ POLB P06746 1/20 0.36
▸ LMNA P02545 1/20 0.35
▸ KDM4E B2RXH2 1/20 0.35

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
SCHEMBL10980011 0.88 CNR1 (0.53) CNR1CNR2THRBMAPTALDH1A1
SCHEMBL10976108 0.86 CNR1 (0.65) CNR1CNR2PDE4BPDE4APDE4C
SCHEMBL10973972 0.86 CNR1 (0.57) CNR1CNR2PDE4BPDE4APDE4C
SCHEMBL10974218 0.86 CNR1 (0.66) CNR1CNR2PDE4BPDE4APDE4C
Hydrochloric Acid SCHEMBL11073900 0.86 CNR1 (0.56) CNR1CNR2PDE4BPDE4APDE4C
SCHEMBL11075597 0.85 CNR1 (0.56) CNR1CNR2PDE4BPDE4APDE4C
SCHEMBL10975710 0.85 CNR1 (0.54) CNR1CNR2PDE4BPDE4APDE4C
SCHEMBL10982516 0.85 CNR1 (0.59) CNR1CNR2PDE4BPDE4APDE4C
SCHEMBL1826000 0.84 CNR1 (0.52) CNR1CNR2PDE4BPDE4APDE4C
SCHEMBL11073496 0.84 CNR1 (0.68) CNR1CNR2PDE4BPDE4APDE4C

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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