SCHEMBL3787440

SCHEMBL3787440

O=C(O)CNC(=O)c1nc(C(=O)c2ccccc2)c2cc(Oc3ccccc3)ccc2c1O

nearest known ligand 0.75

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
THRB P10828 17/20 0.75
THRA P10827 16/20 0.75
EGLN1 Q9GZT9 6/20 0.75
BBOX1 O75936 1/20 0.74
SLC6A2 P23975 1/20 0.74
SLC6A3 Q01959 1/20 0.74
ASPH Q12797 1/20 0.74
KDM8 Q8N371 1/20 0.74
FTO Q9C0B1 1/20 0.74

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
SCHEMBL5140997 0.92 THRB (0.80) THRBTHRAEGLN1BBOX1SLC6A2
SCHEMBL969046 0.86 THRA (0.86) THRBTHRAEGLN1BBOX1SLC6A2
SCHEMBL22168443 0.86 THRA (0.80) THRBTHRAEGLN1BBOX1SLC6A2
SCHEMBL522940 0.86 THRA (1.00) THRBTHRAEGLN1BBOX1SLC6A2
SCHEMBL523415 0.85 THRA (0.74) THRBTHRAEGLN1BBOX1SLC6A2
SCHEMBL27434315 0.85 THRB (1.00) THRBTHRAEGLN1BBOX1SLC6A2
SCHEMBL31028967 0.85 THRA (1.00) THRBTHRAEGLN1BBOX1SLC6A2
Roxadustat SCHEMBL29350689 0.85 THRA (1.00) THRBTHRAEGLN1BBOX1SLC6A2
Roxadustat SCHEMBL523705 0.85 THRA (1.00) THRBTHRAEGLN1BBOX1SLC6A2
Roxadustat SCHEMBL29892426 0.85 THRA (1.00) THRBTHRAEGLN1BBOX1SLC6A2

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-20100331362-A1 Treatment method for anemia FIBROGEN, INC. (US) 2010-12-30 US disclosed
US-20060276477-A1 Treatment method for anemia FIBROGEN, INC. (US) 2006-12-07 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 (2 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-20100331362-A1 Treatment method for anemia THPO, EPOR, MPL THRB 574/4885THRA 247/4885EGLN1 85/4885
US-20060276477-A1 Treatment method for anemia THPO, EPOR, MPL THRB 574/4885THRA 247/4885EGLN1 85/4885

“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.