SCHEMBL3376476

SCHEMBL3376476

COc1ccc(-c2cc(=O)n(-c3ccc(C(=O)O)cc3)[nH]2)cc1OC1CCCC1

nearest known ligand 0.67

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
PDE4B Q07343 14/20 0.67
PDE4A P27815 13/20 0.67
PDE4C Q08493 11/20 0.67
PDE4D Q08499 11/20 0.67
KDM4E B2RXH2 1/20 0.46
ALDH1A1 P00352 1/20 0.46
MAPT P10636 1/20 0.46
KMT2A Q03164 1/20 0.46
SMN1; SMN2 Q16637 1/20 0.46
TDP1 Q9NUW8 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
SCHEMBL3765559 0.90 PDE4A (0.53) PDE4BPDE4APDE4CPDE4D
SCHEMBL7501628 0.83 PDE4A (0.97) PDE4BPDE4APDE4CPDE4D
SCHEMBL7444846 0.81 PDE4A (1.00) PDE4BPDE4APDE4CPDE4D
SCHEMBL3373719 0.80 PDE4B (0.55) PDE4BPDE4APDE4CPDE4D
SCHEMBL3770826 0.80 PDE4A (0.54) PDE4BPDE4APDE4CPDE4DALDH1A1
SCHEMBL3773831 0.78 PDE4B (0.55) PDE4BPDE4APDE4CPDE4DKDM4E
SCHEMBL3370231 0.78 PDE4A (0.52) PDE4BPDE4APDE4CPDE4DALDH1A1
SCHEMBL30009845 0.76 PDE4B (0.80) PDE4BPDE4APDE4CPDE4DKMT2A
SCHEMBL1028427 0.76 PDE4B (0.80) PDE4BPDE4APDE4CPDE4DKMT2A
SCHEMBL28265414 0.76 MAPT (0.51) KDM4EALDH1A1MAPTKMT2ASMN1; SMN2

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 PDE4B 1700/4885PDE4A 1796/4885PDE4C 2308/4885

“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.