SCHEMBL4253928

SCHEMBL4253928

CC(C)(C)OC(=O)NC1CCN(c2ccc([N+](=O)[O-])c(F)c2)C1

nearest known ligand 0.45

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
SUV39H2 Q9H5I1 7/20 0.45
DRD2 P14416 1/20 0.43
F10 P00742 1/20 0.43
PIM1 P11309 1/20 0.42
PIM3 Q86V86 1/20 0.42
PIM2 Q9P1W9 1/20 0.42
CTSK P43235 2/20 0.42
KDM4D Q6B0I6 3/20 0.42
USP30 Q70CQ3 2/20 0.41
TRPV1 Q8NER1 2/20 0.40

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
SCHEMBL4253922 1.00 SUV39H2 (0.45) SUV39H2DRD2F10PIM1PIM3
SCHEMBL7235706 0.89 HPGD (0.48) SUV39H2DRD2PIM1PIM3PIM2
SCHEMBL15093029 0.88 SUV39H2 (0.46) SUV39H2DRD2PIM1PIM3PIM2
SCHEMBL2578938 0.88 SUV39H2 (0.46) SUV39H2DRD2PIM1PIM3PIM2
SCHEMBL3384005 0.88 MAPT (0.48) SUV39H2DRD2PIM1PIM3PIM2
SCHEMBL1350090 0.86 SUV39H2 (0.49) SUV39H2F10PIM1PIM3PIM2
SCHEMBL1350092 0.86 SUV39H2 (0.49) SUV39H2F10PIM1PIM3PIM2
SCHEMBL31331790 0.86 DRD2 (0.45) SUV39H2DRD2PIM1PIM3PIM2
SCHEMBL31331951 0.86 DRD2 (0.45) SUV39H2DRD2PIM1PIM3PIM2
SCHEMBL1350982 0.84 SUV39H2 (0.48) SUV39H2F10PIM1PIM3PIM2

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-8828991-B2 Azacyclyl-substituted arylthienopyrimidinones, process for their preparation and their use as medicaments SANOFI (FR) 2014-09-09 US disclosed
US-20090082339-A1 NOVEL AZACYCLYL-SUBSTITUTED ARYLTHIENOPYRIMIDINONES, PROCESS FOR THEIR PREPARATION AND THEIR USE AS MEDICAMENTS SANOFI-AVENTIS (FR) 2009-03-26 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-20090082339-A1 NOVEL AZACYCLYL-SUBSTITUTED ARYLTHIENOPYRIMIDINONES, PROCESS FOR THEIR PREPARATION AND THEIR USE AS MEDICAMENTS MCHR1, MPI, TPMT SUV39H2 2750/4885DRD2 2102/4885F10 4768/4885

“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.