SCHEMBL11024730

SCHEMBL11024730

CCOC(=O)c1c(C)cc2[nH]c(=O)n(-c3ccccc3C(F)(F)F)c(=O)c2c1C

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ NPC1 O15118 1/20 0.41
▸ GAA P10253 1/20 0.41
▸ SMN1; SMN2 Q16637 1/20 0.41
▸ POLB P06746 1/20 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
▸ CNR1 P21554 1/20 0.38
▸ CNR2 P34972 1/20 0.38
▸ SLC5A1 P13866 1/20 0.38
▸ SLC5A2 P31639 1/20 0.38
▸ ADORA3 P0DMS8 2/20 0.38
▸ ALDH1A1 P00352 2/20 0.37
▸ KDM4E B2RXH2 4/20 0.37
▸ LMNA P02545 2/20 0.37
▸ MEN1 O00255 1/20 0.37
▸ KMT2A Q03164 1/20 0.37

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
SCHEMBL11024247 0.85 MAPT (0.47) NPC1GAASMN1; SMN2POLBADORA1
SCHEMBL10977927 0.81 ALDH1A1 (0.52) ADORA1PDE1APDE1BPDE3BPDE1C
SCHEMBL10972776 0.79 CNR1 (0.54) SMN1; SMN2POLBADORA1PDE1APDE1B
SCHEMBL11340568 0.77 CNR1 (0.52) POLBADORA1PDE1APDE1BPDE3B
SCHEMBL11281609 0.76 NPC1 (0.48) NPC1GAASMN1; SMN2ADORA1PDE1A
SCHEMBL10973770 0.76 CNR1 (0.56) POLBCNR1CNR2SLC5A1SLC5A2
SCHEMBL11216038 0.76 ADORA1 (0.48) NPC1GAASMN1; SMN2POLBADORA1
SCHEMBL10977410 0.75 KDM4E (0.42) GAASMN1; SMN2POLBCNR1CNR2
SCHEMBL11372681 0.75 POLB (0.48) POLBADORA1PDE1APDE1BPDE3B
SCHEMBL11026360 0.74 GAA (0.43) GAASMN1; SMN2POLBALDH1A1KDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0040793-B1 NOVEL QUINAZOLINE-DIONE COMPOUNDS, PROCESS FOR PRODUCTION THEREOF AND PHARMACEUTICAL USE THEREOF Ishikawa, Masayuki (JP) 1985-08-28 — — EP claimed
US-4405623-A HYPOTENSIVE AGENTS, VASODILATORS MASAYUKI ISHIKAWA (JP) 1983-09-20 — — US claimed
EP-0040793-A1 Novel quinazoline-dione compounds, process for production thereof and pharmaceutical use thereof Ishikawa, Masayuki (JP) 1981-12-02 — — EP claimed
EP-0040793-B1 NOVEL QUINAZOLINE-DIONE COMPOUNDS, PROCESS FOR PRODUCTION THEREOF AND PHARMACEUTICAL USE THEREOF Ishikawa, Masayuki (JP) 1985-08-28 — — EP disclosed
US-4405623-A HYPOTENSIVE AGENTS, VASODILATORS MASAYUKI ISHIKAWA (JP) 1983-09-20 — — US disclosed
EP-0040793-A1 Novel quinazoline-dione compounds, process for production thereof and pharmaceutical use thereof Ishikawa, Masayuki (JP) 1981-12-02 — — EP disclosed
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