SCHEMBL4923940

SCHEMBL4923940

CCNc1cc(C#N)cc(COc2c(Cl)cc(CCC(=O)O)cc2Cl)c1

nearest known ligand 0.54

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
THRA P10827 12/20 0.54
THRB P10828 12/20 0.54
FFAR1 O14842 5/20 0.44
FFAR4 Q5NUL3 3/20 0.44
MRGPRX4 Q96LA9 2/20 0.40
ESR1 P03372 1/20 0.38
NR3C1 P04150 1/20 0.38
PGR P06401 1/20 0.38
NR3C2 P08235 1/20 0.38
AR P10275 1/20 0.38

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
SCHEMBL4929246 0.92 THRA (0.45) THRATHRBFFAR1FFAR4MRGPRX4
SCHEMBL4345721 0.89 THRB (0.69) THRATHRBFFAR1FFAR4ESR1
SCHEMBL4929459 0.89 FFAR1 (0.46) THRATHRBFFAR1FFAR4MRGPRX4
SCHEMBL4932744 0.89 THRB (0.41) THRATHRBFFAR1FFAR4MRGPRX4
SCHEMBL5112320 0.88 THRA (0.43) THRATHRBFFAR1FFAR4MRGPRX4
SCHEMBL5119296 0.87 FFAR1 (0.44) THRATHRBFFAR1FFAR4MRGPRX4
SCHEMBL5717865 0.87 THRB (0.54) THRATHRBFFAR1FFAR4ESR1
SCHEMBL4933932 0.86 FFAR4 (0.43) THRATHRBFFAR1FFAR4MRGPRX4
SCHEMBL4923866 0.86 THRA (0.42) THRATHRBFFAR1FFAR4MRGPRX4
SCHEMBL4934663 0.85 THRA (0.59) THRATHRBFFAR1FFAR4ESR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20080221210-A1 Thyroid Receptor Agonists KARO BIO AB (SE) 2008-09-11 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-20080221210-A1 Thyroid Receptor Agonists TSHR, TRHR, THRA THRA 3/4885THRB 4/4885FFAR1 37/4885

“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.