SCHEMBL5758260

SCHEMBL5758260

COCCn1cc(C(=O)NCc2ccncc2)c(=O)n(-c2cccc(Cl)c2)c1=O

nearest known ligand 0.46

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
PDE10A Q9Y233 2/20 0.46
KLKB1 P03952 1/20 0.43
POLB P06746 1/20 0.43
PTGER1 P34995 1/20 0.43
KMT2A Q03164 1/20 0.43
NPSR1 Q6W5P4 1/20 0.42
ELANE P08246 1/20 0.42
CYP1A2 P05177 1/20 0.42
CYP2C9 P11712 1/20 0.42
CYP2C19 P33261 1/20 0.42
CNR2 P34972 1/20 0.42
ABCB1 P08183 1/20 0.41
MAPK7 Q13164 1/20 0.41
MAPK14 Q16539 1/20 0.41
P2RX7 Q99572 1/20 0.41
MAPK8 P45983 1/20 0.41
MAPK1 P28482 1/20 0.40
HTT P42858 1/20 0.40
ROCK2 O75116 1/20 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
SCHEMBL5756461 0.92 PDE10A (0.48) PDE10AKLKB1KMT2AELANECNR2
SCHEMBL5759073 0.90 TP53 (0.49) PDE10AKLKB1POLBKMT2AELANE
SCHEMBL5757653 0.89 CNR2 (0.47) PDE10APOLBPTGER1KMT2ANPSR1
SCHEMBL5759317 0.89 TP53 (0.52) PDE10AKMT2AELANECNR2ABCB1
SCHEMBL5759479 0.89 PDE10A (0.48) PDE10AELANECYP1A2CYP2C9CYP2C19
SCHEMBL5756939 0.89 KLKB1 (0.47) PDE10AKLKB1KMT2AELANE
SCHEMBL5757834 0.89 ELANE (0.51) ELANE
SCHEMBL5758809 0.88 PDE10A (0.45) PDE10AKLKB1KMT2AELANEP2RX7
SCHEMBL27624377 0.88 PDE10A (0.45) PDE10AKLKB1KMT2AELANECNR2
SCHEMBL5759410 0.87 PDE10A (0.48) PDE10AKLKB1KMT2AELANECNR2

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
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

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 2816/4885KLKB1 262/4885POLB 833/4885

“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.