SCHEMBL3374185

SCHEMBL3374185

COc1ccc(-c2cc(=O)[nH][nH]2)cc1OC1Cc2ccccc2C1

nearest known ligand 0.64

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 2/20 0.64
MAPT P10636 2/20 0.64
THRB P10828 2/20 0.64
PDE4B Q07343 5/20 0.59
PDE4A P27815 3/20 0.59
PDE4C Q08493 3/20 0.59
PDE4D Q08499 3/20 0.59
GAA P10253 1/20 0.46
PKM P14618 1/20 0.46
TDP1 Q9NUW8 1/20 0.46
NPY5R Q15761 1/20 0.44
SLC6A4 P31645 2/20 0.41

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 0.84 MAPT (0.69) KDM4EMAPTTHRBPDE4BPDE4A
SCHEMBL3371490 0.82 PDE4B (0.56) KDM4EMAPTTHRBPDE4BPDE4A
SCHEMBL3373532 0.79 MAPT (0.69) KDM4EMAPTTHRBPDE4BPDE4A
SCHEMBL7361110 0.78 PDE4B (0.56) KDM4EPDE4BPDE4APDE4CPDE4D
SCHEMBL3773831 0.78 PDE4B (0.55) KDM4EMAPTPDE4BPDE4APDE4C
SCHEMBL7355624 0.77 PDE4B (0.57) PDE4BPDE4APDE4CPDE4DNPY5R
SCHEMBL3374189 0.75 PDE4B (0.58) PDE4BPDE4APDE4CPDE4DNPY5R
SCHEMBL7359838 0.74 PDE4B (0.55) PDE4BPDE4APDE4CPDE4DSLC6A4
SCHEMBL3374398 0.74 PDE4B (0.57) PDE4BPDE4APDE4CPDE4D
SCHEMBL3374951 0.72 KDM4E (0.68) KDM4EMAPTTHRBPDE4BPDE4A

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 KDM4E 4172/4885MAPT 2810/4885THRB 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.