SCHEMBL498087

SCHEMBL498087

COc1ccc(-c2cnn(Cn3c(=O)sc4ccccc43)c(=O)c2)cc1OC1CCCC1

nearest known ligand 0.45

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
TSHR P16473 3/20 0.45
LMNA P02545 1/20 0.45
HTT P42858 1/20 0.45
PDE4A P27815 12/20 0.44
PDE4D Q08499 10/20 0.44
PDE4B Q07343 9/20 0.44
PDE4C Q08493 9/20 0.44
GAA P10253 1/20 0.41
USP2 O75604 1/20 0.40
GLA P06280 1/20 0.40
PKM P14618 1/20 0.40
THRB P10828 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39

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
SCHEMBL498253 0.76 PDE4A (0.48) PDE4APDE4DPDE4BPDE4C
SCHEMBL497699 0.74 PDE4A (0.56) PDE4APDE4DPDE4BPDE4C
SCHEMBL498212 0.74 PDE4A (0.52) PDE4APDE4DPDE4BPDE4C
SCHEMBL498367 0.74 PDE4A (0.55) PDE4APDE4DPDE4BPDE4CGAA
SCHEMBL498252 0.71 PDE4A (0.50) PDE4APDE4DPDE4BPDE4C
SCHEMBL3234862 0.69 PDE4A (0.48) PDE4APDE4DPDE4BPDE4CPKM
SCHEMBL5823060 0.68 PDE4A (0.77) PDE4APDE4DPDE4BPDE4C
SCHEMBL7696540 0.67 PDE4A (0.72) PDE4APDE4DPDE4BPDE4C
SCHEMBL4642754 0.67 PDE4A (0.52) PDE4APDE4DPDE4BPDE4C
SCHEMBL3260690 0.66 PDE4A (0.48) PDE4APDE4DPDE4BPDE4C

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2157084-B1 5-PHENYL-3-PYRIDAZINONE DERIVATIVE KOWA CO (JP) 2013-05-22 EP disclosed
US-8106053-B2 5-phenyl-3-pyridazinone derivative KOWA COMPANY, LTD. 2012-01-31 US disclosed
US-20100197698-A1 5-PHENYL-3-PYRIDAZINONE DERIVATIVE KOWA COMPANY, LTD. (JP) 2010-08-05 US disclosed
EP-2157084-A1 5-PHENYL-3-PYRIDAZINONE DERIVATIVE Kowa Company, Ltd. (JP) 2010-02-24 EP 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-20100197698-A1 5-PHENYL-3-PYRIDAZINONE DERIVATIVE SERPINE1, MMP1, PLAT TSHR 3650/4885LMNA 715/4885HTT 3939/4885

“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.