SCHEMBL14775916

SCHEMBL14775916

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

nearest known ligand 0.60

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ PDE7A Q13946 10/20 0.60
▸ PDE7B Q9NP56 5/20 0.59
▸ PDE8A O60658 3/20 0.59
▸ FEN1 P39748 1/20 0.41
▸ TSHR P16473 1/20 0.40
▸ ESR1 P03372 2/20 0.40
▸ SIGMAR1 Q99720 1/20 0.39
▸ NPC1 O15118 1/20 0.39
▸ RAB9A P51151 1/20 0.39
▸ CYP3A4 P08684 1/20 0.39
▸ CYP2D6 P10635 1/20 0.39
▸ KDM4E B2RXH2 1/20 0.39
▸ ALDH1A1 P00352 1/20 0.39
▸ HPGD P15428 1/20 0.39
▸ HSD17B10 Q99714 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
SCHEMBL100580 0.93 PDE7A (0.60) PDE7APDE7BPDE8AFEN1ESR1
SCHEMBL17416726 0.91 PDE7A (0.55) PDE7APDE7BPDE8AFEN1TSHR
SCHEMBL474204 0.90 PDE7A (0.59) PDE7APDE7BPDE8AFEN1TSHR
SCHEMBL99845 0.90 PDE7A (0.62) PDE7APDE7BPDE8AFEN1TSHR
SCHEMBL100025 0.89 PDE7A (0.56) PDE7APDE7BPDE8ATSHR
SCHEMBL173169 0.88 PDE7A (0.56) PDE7APDE7BPDE8AFEN1ESR1
SCHEMBL3649285 0.88 PDE7A (0.67) PDE7APDE7BPDE8ATSHRNPC1
SCHEMBL99714 0.88 PDE7A (0.76) PDE7APDE7BPDE8ATSHRESR1
SCHEMBL585427 0.87 PDE7A (0.76) PDE7APDE7BPDE8ATSHRKDM4E
SCHEMBL173189 0.86 PDE7A (0.57) PDE7APDE7BPDE8AFEN1TSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2411009-B1 Therapeutic uses of quinazolinedione derivatives SANOFI SA (FR) 2013-03-20 — — EP disclosed
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