SCHEMBL6030559

SCHEMBL6030559

O=[C]Cc1ccc2c(c1)NC(=O)CO2

nearest known ligand 0.68

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
PARP1 P09874 5/20 0.68
NR3C2 P08235 4/20 0.57
MMP12 P39900 1/20 0.56
DRD4 P21917 6/20 0.52
DRD2 P14416 5/20 0.52
DRD3 P35462 3/20 0.52
ALDH1A1 P00352 2/20 0.51
MAPT P10636 1/20 0.51
KMT2A Q03164 1/20 0.50
SMN1; SMN2 Q16637 1/20 0.50
NPSR1 Q6W5P4 1/20 0.50
TSHR P16473 1/20 0.47

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
SCHEMBL11002313 0.84 PARP1 (0.77) PARP1NR3C2MMP12DRD4DRD2
SCHEMBL9437898 0.82 PARP1 (0.68) PARP1NR3C2MMP12DRD4DRD2
SCHEMBL532134 0.81 PARP1 (1.00) PARP1NR3C2MMP12DRD4DRD2
SCHEMBL28693938 0.81 PARP1 (0.72) PARP1NR3C2MMP12DRD4DRD2
SCHEMBL554735 0.81 PARP1 (0.72) PARP1NR3C2MMP12DRD4DRD2
SCHEMBL351961 0.81 PARP1 (0.72) PARP1NR3C2MMP12DRD4DRD2
SCHEMBL4258386 0.81 PARP1 (0.73) PARP1NR3C2MMP12DRD4DRD2
Hydrochloric Acid SCHEMBL3557170 0.80 PARP1 (0.70) PARP1NR3C2MMP12DRD4DRD2
SCHEMBL11006154 0.80 PARP1 (0.70) PARP1NR3C2MMP12DRD4DRD2
SCHEMBL11004751 0.80 PARP1 (0.70) PARP1NR3C2MMP12DRD4DRD2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20060094710-A1 Piperidine-pyridazones and phthalazones as pde4 inhibitors ALTANA PHARMA AG (DE) 2006-05-04 US claimed
EP-1556049-A1 PIPERIDINE-PYRIDAZONES AND PHTHALAZONES AS PDE4 INHIBITORS ALTANA Pharma AG (DE) 2005-07-27 EP claimed
WO-2004017974-A1 PIPERIDINE-PYRIDAZONES AND PHTHALAZONES AS PDE4 INHIBITORS ALTANA PHARMA AG (DE) 2004-03-04 WO claimed
US-20060094710-A1 Piperidine-pyridazones and phthalazones as pde4 inhibitors ALTANA PHARMA AG (DE) 2006-05-04 US disclosed
EP-1556049-A1 PIPERIDINE-PYRIDAZONES AND PHTHALAZONES AS PDE4 INHIBITORS ALTANA Pharma AG (DE) 2005-07-27 EP disclosed
WO-2004017974-A1 PIPERIDINE-PYRIDAZONES AND PHTHALAZONES AS PDE4 INHIBITORS ALTANA PHARMA AG (DE) 2004-03-04 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-20060094710-A1 Piperidine-pyridazones and phthalazones as pde4 inhibitors PDE4A, PDE4B, PDE3A PARP1 1117/4885NR3C2 680/4885MMP12 1015/4885

“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.