SCHEMBL3140970

SCHEMBL3140970

CC(C)n1c(CC2CCCC2)nc2ccc(Oc3c(Br)cc(CC(F)C(=O)O)cc3Br)cc21

nearest known ligand 0.38

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
THRA P10827 12/20 0.35
THRB P10828 12/20 0.35
NR1H4 Q96RI1 2/20 0.33
ACACB O00763 1/20 0.33
PPARG P37231 1/20 0.33
MCHR1 Q99705 1/20 0.32

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
SCHEMBL3142062 0.87 THRA (0.38) THRATHRBPPARG
SCHEMBL3142258 0.75 THRA (0.36) THRATHRBPPARG
SCHEMBL3128023 0.74 ACSS2 (0.35) THRATHRBPPARG
SCHEMBL3136098 0.74 ACSS2 (0.35) THRATHRBPPARG
SCHEMBL3127197 0.73 THRA (0.35) THRATHRBPPARG
SCHEMBL3130577 0.73 ACSS2 (0.40) THRATHRBPPARG
SCHEMBL3133600 0.73 ACSS2 (0.40) THRATHRBPPARG
SCHEMBL3142133 0.73 POLB (0.45) THRATHRB
SCHEMBL3137672 0.72 RAF1 (0.37) THRATHRB
SCHEMBL3137299 0.71 THRA (0.39) THRATHRBPPARG

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-20100004271-A1 HETEROCYCLIC COMPOUNDS AS AGANIST FOR THE THYROID RECEPTOR KARO BIO AB (SE) 2010-01-07 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 (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-20100004271-A1 HETEROCYCLIC COMPOUNDS AS AGANIST FOR THE THYROID RECEPTOR TSHR, GHSR, TRHR THRA 4/4885THRB 6/4885NR1H4 150/4885

“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.