SCHEMBL3129784

SCHEMBL3129784

Cc1c(Oc2c(Br)cc(NC(=O)CC(=O)O)cc2Br)ccc2nc(CC(C)C)sc12

nearest known ligand 0.46

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
THRB P10828 8/20 0.46
THRA P10827 7/20 0.46
SMN1; SMN2 Q16637 2/20 0.35
TP53 P04637 1/20 0.35
MAPT P10636 1/20 0.35
RXFP1 Q9HBX9 1/20 0.35
KCNH2 Q12809 1/20 0.33
LDHA P00338 1/20 0.33
ACP1 P24666 1/20 0.33
NPC1 O15118 2/20 0.33
RAB9A P51151 2/20 0.33
KDM4E B2RXH2 1/20 0.33
ALDH1A1 P00352 1/20 0.33
MEN1 O00255 1/20 0.31
KMT2A Q03164 1/20 0.31

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
SCHEMBL3138167 0.81 PPARA (0.34) THRBTHRA
SCHEMBL3138235 0.76 THRA (0.42) THRBTHRA
SCHEMBL3979678 0.69 THRA (0.56) THRBTHRAMAPTLDHAALDH1A1
SCHEMBL3146203 0.68 THRA (0.58) THRBTHRAKCNH2NPC1RAB9A
SCHEMBL3140784 0.64 THRA (0.55) THRBTHRAMAPTNPC1RAB9A
SCHEMBL3137511 0.64 THRA (0.52) THRBTHRAMAPT
Eprotirome SCHEMBL759034 0.63 THRA (1.00) THRBTHRA
Eprotirome SCHEMBL29357083 0.63 THRA (1.00) THRBTHRA
SCHEMBL3133764 0.63 THRA (0.54) THRBTHRA
SCHEMBL3136227 0.61 HDAC1 (0.38) THRBTHRAMEN1KMT2A

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 THRB 6/4885THRA 4/4885SMN1; SMN2 4757/4885

“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.