SCHEMBL4935573

SCHEMBL4935573

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

nearest known ligand 0.45

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
PPARD Q03181 1/20 0.45
TRPA1 O75762 7/20 0.45
CYP1A2 P05177 2/20 0.45
THRB P10828 6/20 0.41
MRGPRX4 Q96LA9 3/20 0.41
THRA P10827 4/20 0.40
RXRA P19793 1/20 0.39
RXRB P28702 1/20 0.39
RXRG P48443 1/20 0.39
SMN1; SMN2 Q16637 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
SCHEMBL4931818 0.92 PPARD (0.46) PPARDTRPA1THRBMRGPRX4THRA
SCHEMBL5717974 0.91 TRPA1 (0.42) PPARDTRPA1CYP1A2THRBMRGPRX4
SCHEMBL4928689 0.89 THRA (0.50) TRPA1CYP1A2THRBMRGPRX4THRA
SCHEMBL4932092 0.89 THRB (0.51) TRPA1CYP1A2THRBTHRARXRA
SCHEMBL4929395 0.88 PPARD (0.47) PPARDTHRBMRGPRX4THRARXRA
SCHEMBL4925262 0.86 THRB (0.42) PPARDTHRBMRGPRX4THRA
SCHEMBL4931483 0.86 TRPA1 (0.47) TRPA1CYP1A2MRGPRX4SMN1; SMN2
SCHEMBL5107813 0.86 THRB (0.46) PPARDTHRBMRGPRX4THRARXRA
SCHEMBL5108768 0.86 PPARD (0.46) PPARDTHRBMRGPRX4THRARXRA
SCHEMBL4923914 0.85 TRPA1 (0.42) PPARDTRPA1CYP1A2MRGPRX4

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 PPARD 284/4885TRPA1 675/4885CYP1A2 1307/4885

“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.