SCHEMBL100508

SCHEMBL100508

CCOc1cc(Cn2c(=O)c3cc(OC(CF)CF)c(F)cc3n(C3CCN(C=O)CC3)c2=O)cc(Cl)c1COc1ccc(Cl)cc1

nearest known ligand 0.55

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
PDE7A Q13946 10/20 0.55
PDE7B Q9NP56 5/20 0.55
PDE8A O60658 3/20 0.55
S1PR1 P21453 1/20 0.32
OPRM1 P35372 1/20 0.30
OPRL1 P41146 1/20 0.30

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
SCHEMBL141496 0.89 PDE7A (0.54) PDE7APDE7BPDE8A
SCHEMBL100195 0.89 PDE7A (0.60) PDE7APDE7BPDE8AS1PR1
SCHEMBL100537 0.89 PDE7A (0.60) PDE7APDE7BPDE8AS1PR1
SCHEMBL101022 0.86 PDE7A (0.51) PDE7APDE7BPDE8A
SCHEMBL101209 0.86 PDE7A (0.59) PDE7APDE7BPDE8AS1PR1OPRM1
SCHEMBL101040 0.86 PDE7A (0.66) PDE7APDE7BPDE8AOPRM1OPRL1
SCHEMBL100406 0.86 PDE7A (0.53) PDE7APDE7BPDE8A
SCHEMBL101041 0.85 PDE7A (0.57) PDE7APDE7BPDE8AS1PR1
SCHEMBL101053 0.85 PDE7A (0.63) PDE7APDE7BPDE8A
SCHEMBL30837809 0.84 PDE7A (0.58) PDE7APDE7BPDE8AS1PR1OPRM1

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
US-8748441-B2 Therapeutic uses of quinazolinedione derivatives SANOFI (FR) 2014-06-10 US disclosed
US-8748441-B2 Therapeutic uses of quinazolinedione derivatives SANOFI (FR) 2014-06-10 US disclosed
US-20120058987-A1 THERAPEUTIC USES OF QUINAZOLINEDIONE DERIVATIVES SANOFI (FR) 2012-03-08 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20120058987-A1 THERAPEUTIC USES OF QUINAZOLINEDIONE DERIVATIVES SLC5A2, SLC5A1, PPARD PDE7A 1520/4885PDE7B 1364/4885PDE8A 2069/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.