SCHEMBL3649285

SCHEMBL3649285

COc1ccc(Cn2c(=O)c3cc(OCc4ccccc4)ccc3n(C3CCN(C(=O)O)CC3)c2=O)cc1OC

nearest known ligand 0.67

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ PDE7A Q13946 10/20 0.67
▸ PDE7B Q9NP56 5/20 0.61
▸ PDE8A O60658 3/20 0.61
▸ NPC1 O15118 1/20 0.46
▸ RAB9A P51151 1/20 0.46
▸ MEN1 O00255 1/20 0.43
▸ KMT2A Q03164 1/20 0.43
▸ OXTR P30559 1/20 0.42
▸ CYP3A4 P08684 2/20 0.42
▸ CYP2D6 P10635 2/20 0.42
▸ PLA2G2A P14555 1/20 0.42
▸ TSHR P16473 1/20 0.42

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
SCHEMBL100515 0.94 PDE7A (0.66) PDE7APDE7BPDE8ANPC1RAB9A
SCHEMBL14782104 0.94 PDE7A (0.65) PDE7APDE7BPDE8ANPC1RAB9A
SCHEMBL17416742 0.92 PDE7A (0.60) PDE7APDE7BPDE8ANPC1RAB9A
SCHEMBL99965 0.91 PDE7A (0.62) PDE7APDE7BPDE8ANPC1RAB9A
SCHEMBL100114 0.90 PDE7A (0.80) PDE7APDE7BPDE8ANPC1RAB9A
SCHEMBL2683924 0.88 PDE7A (0.63) PDE7APDE7BPDE8ANPC1RAB9A
SCHEMBL133527 0.88 PDE7A (0.63) PDE7APDE7BPDE8ANPC1RAB9A
SCHEMBL582570 0.88 PDE7A (0.77) PDE7APDE7BPDE8ANPC1RAB9A
SCHEMBL14775916 0.88 PDE7A (0.60) PDE7APDE7BPDE8ANPC1RAB9A
SCHEMBL582751 0.87 PDE7A (0.62) PDE7APDE7BPDE8ANPC1RAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2205593-B1 QUINAZOLINEDIONE DERIVATIVES, PREPARATION THEREOF AND THERAPEUTIC USES THEREOF SANOFI SA (FR) 2016-01-13 — — EP disclosed
EP-2416777-B1 THERAPEUTIC APPLICATIONS IN THE CARDIOVASCULAR FIELD OF QUINAZOLINEDIONE DERIVATIVES SANOFI SA (FR) 2014-11-12 — — EP disclosed
CN-102458409-B Therapeutic applications in the cardiovascular field of quinazolinedione derivatives SANOFI AVENTIS 2014-06-18 — — CN disclosed
EP-2411009-B1 Therapeutic uses of quinazolinedione derivatives SANOFI SA (FR) 2013-03-20 — — EP disclosed
WO-2010116090-A1 THERAPEUTIC APPLICATIONS IN THE CARDIOVASCULAR FIELD OF QUINAZOLINEDIONE DERIVATIVES SANOFI-AVENTIS (FR) 2010-10-14 — — WO disclosed
WO-2010109148-A1 THERAPEUTIC USES OF QUINAZOLINEDIONE DERIVATIVES SANOFI-AVENTIS (FR) 2010-09-30 — — WO disclosed
EP-2205593-A1 QUINAZOLINEDIONE DERIVATIVES, PREPARATION THEREOF AND THERAPEUTIC USES THEREOF Sanofi-Aventis (FR) 2010-07-14 — — EP disclosed
WO-2009077680-A1 QUINAZOLINEDIONE DERIVATIVES, PREPARATION THEREOF AND THERAPEUTIC USES THEREOF SANOFI-AVENTIS (FR) 2009-06-25 — — WO disclosed
WO-2009077680-A1 QUINAZOLINEDIONE DERIVATIVES, PREPARATION THEREOF AND THERAPEUTIC USES THEREOF SANOFI-AVENTIS (FR) 2009-06-25 — — WO disclosed
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