SCHEMBL2071896

SCHEMBL2071896

Cc1cc(C2=NNC(=O)CC2C)c2c(c1)N(C)C(=O)CO2

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
PDE3B Q13370 18/20 1.00
PDE3A Q14432 18/20 1.00
PDE4A P27815 1/20 0.44
PDE4B Q07343 1/20 0.44
PDE4C Q08493 1/20 0.44
PDE4D Q08499 1/20 0.44

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
SCHEMBL7343962 0.81 PDE3B (0.68) PDE3BPDE3APDE4D
SCHEMBL7340299 0.80 PDE3B (0.68) PDE3BPDE3APDE4APDE4BPDE4C
SCHEMBL1386597 0.78 PDE3A (1.00) PDE3BPDE3APDE4APDE4BPDE4C
SCHEMBL7343071 0.78 PDE3B (1.00) PDE3BPDE3APDE4APDE4BPDE4C
SCHEMBL7341201 0.74 PDE3B (0.83) PDE3BPDE3APDE4APDE4BPDE4C
SCHEMBL7349060 0.74 PDE3B (1.00) PDE3BPDE3APDE4APDE4BPDE4C
SCHEMBL7343361 0.73 PDE3B (0.70) PDE3BPDE3APDE4APDE4BPDE4C
SCHEMBL11322663 0.68 PDE3B (0.69) PDE3BPDE3APDE4APDE4BPDE4C
SCHEMBL20278399 0.67 PDE3B (0.52) PDE3BPDE3APDE4D
SCHEMBL10267004 0.67 PDE3B (0.52) PDE3BPDE3APDE4D

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2522670-A1 Heterocyclic CRF receptor antagonists Takeda Pharmaceutical Company Limited (JP) 2012-11-14 EP claimed
US-20070179165-A1 Cyclic compounds GYORKOS ALBERT C 2007-08-02 US claimed
EP-2522670-A1 Heterocyclic CRF receptor antagonists Takeda Pharmaceutical Company Limited (JP) 2012-11-14 EP disclosed
US-7897607-B2 Cyclic compounds TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2011-03-01 US disclosed
US-20070179165-A1 Cyclic compounds GYORKOS ALBERT C 2007-08-02 US 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-20070179165-A1 Cyclic compounds CRHR1, CRHR2, MC2R PDE3B 937/4885PDE3A 1060/4885PDE4A 1448/4885

“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.