SCHEMBL11920451

SCHEMBL11920451

O=CN1CCC(n2c(=O)n(Cc3ccc(C4=CCCS4)nc3)c(=O)c3cc(OC(CF)CF)c(F)cc32)CC1

nearest known ligand 0.52

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ PDE7A Q13946 10/20 0.52
▸ PDE7B Q9NP56 5/20 0.52
▸ PDE8A O60658 3/20 0.52
▸ TSHR P16473 1/20 0.31
▸ CRHBP P24387 1/20 0.31
▸ CRHR2 Q13324 1/20 0.31
▸ SMN1; SMN2 Q16637 1/20 0.31
▸ NPSR1 Q6W5P4 1/20 0.31

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
SCHEMBL100993 0.87 PDE7A (0.55) PDE7APDE7BPDE8ATSHRCRHBP
SCHEMBL100103 0.87 PDE7A (0.55) PDE7APDE7BPDE8ATSHRCRHBP
SCHEMBL100396 0.86 PDE7A (0.53) PDE7APDE7BPDE8ATSHRCRHBP
SCHEMBL32681322 0.86 PDE7A (0.53) PDE7APDE7BPDE8ATSHRCRHBP
SCHEMBL101167 0.85 PDE7A (0.53) PDE7APDE7BPDE8ATSHRCRHBP
SCHEMBL100395 0.84 PDE7A (0.62) PDE7APDE7BPDE8A
SCHEMBL30837936 0.84 PDE7A (0.62) PDE7APDE7BPDE8A
SCHEMBL173205 0.84 PDE7A (0.52) PDE7APDE7BPDE8ATSHRCRHBP
SCHEMBL30837867 0.83 PDE7A (0.58) PDE7APDE7BPDE8A
SCHEMBL100928 0.83 PDE7A (0.58) PDE7APDE7BPDE8A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8242126-B2 Quinazolinedione derivatives, preparation thereof and therapeutic uses thereof SANOFI (FR) 2012-08-14 — — US disclosed
US-20100298298-A1 QUINAZOLINEDIONE DERIVATIVES, PREPARATION THEREOF AND THERAPEUTIC USES THEREOF SANOFI-AVENTIS (FR) 2010-11-25 — — 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-20100298298-A1 QUINAZOLINEDIONE DERIVATIVES, PREPARATION THEREOF AND THERAPEUTIC USES THEREOF PPARD, DPP4, NDUFB7 PDE7A 941/4885PDE7B 1077/4885PDE8A 2165/4885

“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.

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