SCHEMBL3137299

SCHEMBL3137299

CC(C)Cc1nc2ccc(Oc3c(Br)cc(OCC(=O)O)cc3Br)cc2n1C(C)C

nearest known ligand 0.53

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
THRA P10827 6/20 0.39
THRB P10828 6/20 0.39
DPP4 P27487 2/20 0.39
ACSS2 Q9NR19 1/20 0.38
MEN1 O00255 1/20 0.37
KMT2A Q03164 1/20 0.37
PPARG P37231 5/20 0.37
POLB P06746 1/20 0.36
PDE10A Q9Y233 1/20 0.36

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
SCHEMBL3131701 0.88 ACSS2 (0.48) THRATHRBDPP4ACSS2PPARG
SCHEMBL5136430 0.85 MEN1 (0.39) THRATHRBMEN1KMT2APPARG
SCHEMBL5136428 0.85 MEN1 (0.37) THRATHRBMEN1KMT2APPARG
SCHEMBL3137471 0.84 THRB (0.53) THRATHRBDPP4ACSS2MEN1
SCHEMBL3142062 0.83 THRA (0.38) THRATHRBPPARGPDE10A
SCHEMBL3989613 0.74 THRB (0.41) THRATHRBDPP4
SCHEMBL3131649 0.74 POLB (0.48) ACSS2POLB
SCHEMBL3142267 0.73 THRA (0.41) THRATHRBACSS2
SCHEMBL3129981 0.73 THRA (0.56) THRATHRBPOLB
SCHEMBL3137537 0.72 PTPN7 (0.44) THRATHRBMEN1KMT2A

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 3 patents. 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
EP-1899309-A1 HETEROCYCLIC COMPOUNDS AS AGONISTS FOR THE THYROID RECEPTOR KARO BIO AB (SE) 2008-03-19 EP disclosed
WO-2007003419-A1 HETEROCYCLIC COMPOUNDS AS AGONISTS FOR THE THYROID RECEPTOR KARO BIO AB (SE) 2007-01-11 WO 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 6/4885DPP4 1970/4885

“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.