SCHEMBL4928689

SCHEMBL4928689

CCCNc1cc(COc2c(Cl)cc(CCC(=O)O)cc2Cl)cc(C(F)(F)F)c1

nearest known ligand 0.50

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
THRA P10827 5/20 0.50
THRB P10828 5/20 0.50
TRPA1 O75762 5/20 0.43
CYP1A2 P05177 2/20 0.43
FFAR4 Q5NUL3 7/20 0.43
FFAR1 O14842 5/20 0.43
MRGPRX4 Q96LA9 1/20 0.40

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
SCHEMBL4932268 0.93 THRA (0.54) THRATHRBTRPA1FFAR4FFAR1
SCHEMBL4935573 0.89 PPARD (0.45) THRATHRBTRPA1CYP1A2MRGPRX4
SCHEMBL4932512 0.88 THRA (0.53) THRATHRBFFAR4FFAR1MRGPRX4
SCHEMBL4931911 0.87 THRA (0.49) THRATHRBFFAR4FFAR1
SCHEMBL5116030 0.87 THRA (0.49) THRATHRBFFAR4FFAR1MRGPRX4
SCHEMBL5107899 0.86 THRA (0.51) THRATHRBFFAR4FFAR1MRGPRX4
SCHEMBL4926585 0.86 THRA (0.48) THRATHRBFFAR4FFAR1
SCHEMBL4931010 0.86 THRA (0.48) THRATHRBFFAR4FFAR1
SCHEMBL4928023 0.85 THRA (0.50) THRATHRBTRPA1FFAR4FFAR1
SCHEMBL4930946 0.85 THRA (0.48) THRATHRBFFAR4FFAR1MRGPRX4

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 4/4885TRPA1 675/4885

“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.