SCHEMBL5759880

SCHEMBL5759880

CCCCn1cc(C(=O)NCc2cc(C)on2)c(=O)n(-c2cccc(C#N)c2)c1=O

nearest known ligand 0.40

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
PDE10A Q9Y233 1/20 0.40
CNR2 P34972 5/20 0.39
CNR1 P21554 3/20 0.39
DRD2 P14416 1/20 0.38
DRD3 P35462 1/20 0.38
P2RX3 P56373 1/20 0.36
NOTUM Q6P988 2/20 0.36
ELANE P08246 4/20 0.35
GRM2 Q14416 1/20 0.35
NPC1 O15118 1/20 0.34
RAB9A P51151 1/20 0.34
ABCB1 P08183 1/20 0.34
KCNJ1 P48048 1/20 0.34

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
SCHEMBL5759404 0.89 PDE10A (0.42) PDE10ACNR2CNR1P2RX3ELANE
SCHEMBL5755266 0.86 ELANE (0.44) PDE10ACNR2CNR1ELANE
SCHEMBL5758877 0.84 CNR2 (0.45) PDE10ACNR2CNR1DRD2DRD3
SCHEMBL5759860 0.84 CNR2 (0.45) PDE10ACNR2CNR1DRD2DRD3
SCHEMBL5757111 0.82 ELANE (0.45) PDE10ACNR1NOTUMELANENPC1
SCHEMBL5758356 0.82 PDE10A (0.43) PDE10ACNR2CNR1ELANE
SCHEMBL5756906 0.82 CNR2 (0.43) CNR2CNR1DRD2DRD3ELANE
SCHEMBL5760152 0.82 CNR1 (0.43) CNR2CNR1ELANEABCB1
SCHEMBL5757494 0.81 CNR2 (0.42) CNR2CNR1DRD2DRD3
SCHEMBL27624389 0.81 CNR2 (0.42) PDE10ACNR2CNR1DRD2DRD3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1562902-B1 2-PYRIDONE DERIVATIVES AS INHIBITORS OF NEUTROPHILE ELASTASE ASTRAZENECA AB (SE) 2006-05-03 EP disclosed
US-20060035938-A1 2-Pyridone derivatives as inhibitors of neutrophile elastase ASRAZENECA AB (SE) 2006-02-16 US disclosed
CN-1711243-A 2-pyridone derivatives as inhibitors of neutrophil elastase ASTRAZENECA AB (SE) 2005-12-21 CN disclosed
EP-1562902-A1 2-PYRIDONE DERIVATIVES AS INHIBITORS OF NEUTROPHILE ELASTASE AstraZeneca AB (SE) 2005-08-17 EP disclosed
WO-2004043924-A1 2-PYRIDONE DERIVATIVES AS INHIBITORS OF NEUTROPHILE ELASTASE ASTRAZENECA AB (SE) 2004-05-27 WO 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-20060035938-A1 2-Pyridone derivatives as inhibitors of neutrophile elastase SERPINB1, ELANE, SERPINE1 PDE10A 2816/4885CNR2 2164/4885CNR1 2232/4885

“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.