SCHEMBL3373532

SCHEMBL3373532

COc1cc(-c2cc(=O)[nH][nH]2)ccc1OC1CCCC1

nearest known ligand 0.69

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.69
KDM4E B2RXH2 2/20 0.69
THRB P10828 2/20 0.69
PDE4A P27815 14/20 0.51
PDE4B Q07343 14/20 0.50
PDE4C Q08493 13/20 0.50
PDE4D Q08499 13/20 0.50
TDP1 Q9NUW8 2/20 0.49
PKM P14618 1/20 0.49
GAA P10253 2/20 0.48
HSP90AA1 P07900 1/20 0.48
KMT2A Q03164 1/20 0.48
PDE3A Q14432 1/20 0.46

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
SCHEMBL3375192 0.95 MAPT (0.69) MAPTKDM4ETHRBPDE4APDE4B
SCHEMBL3377462 0.82 MAPT (0.48) MAPTKDM4ETHRBPDE4APDE4B
SCHEMBL3374185 0.79 KDM4E (0.64) MAPTKDM4ETHRBPDE4APDE4B
SCHEMBL3770826 0.76 PDE4A (0.54) MAPTPDE4APDE4BPDE4CPDE4D
SCHEMBL3374951 0.75 KDM4E (0.68) MAPTKDM4ETHRBPDE4APDE4B
SCHEMBL5823060 0.75 PDE4A (0.77) PDE4APDE4BPDE4CPDE4D
SCHEMBL3373535 0.73 PDE4A (0.50) PDE4APDE4BPDE4CPDE4D
SCHEMBL8523190 0.73 PDE4A (0.58) MAPTPDE4APDE4BPDE4CPDE4D
SCHEMBL3370231 0.72 PDE4A (0.52) MAPTPDE4APDE4BPDE4CPDE4D
SCHEMBL497727 0.71 PDE4A (0.57) PDE4APDE4BPDE4CPDE4D

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-20100324091-A1 Pyrazolone Derivative KOWA COMPANY, LTD. (JP) 2010-12-23 US disclosed
EP-2172458-A1 PYRAZOLONE DERIVATIVE Kowa Company, Ltd. (JP) 2010-04-07 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-20100324091-A1 Pyrazolone Derivative SERPINE1, SERPINC1, TFPI MAPT 2810/4885KDM4E 4172/4885THRB 2909/4885

“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.