SCHEMBL2169971

SCHEMBL2169971

CCOC(=O)C(C)ON=Cc1cc(Br)c(Oc2ccc(O)c(C(O)c3ccc(Cl)cc3)c2)c(Br)c1

nearest known ligand 0.45

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
THRA P10827 11/20 0.44
THRB P10828 11/20 0.44
MEN1 O00255 1/20 0.38
LMNA P02545 1/20 0.38
MAPT P10636 1/20 0.38
KMT2A Q03164 1/20 0.38
NPSR1 Q6W5P4 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
SCHEMBL2169463 0.91 THRA (0.45) THRATHRB
SCHEMBL16496563 0.84 THRB (0.38) THRATHRBMEN1LMNAMAPT
SCHEMBL2169679 0.84 THRB (0.38) THRATHRBMEN1LMNAMAPT
SCHEMBL2169968 0.84 LMNA (0.40) THRATHRBMEN1LMNAMAPT
SCHEMBL16496121 0.82 THRA (0.46) THRATHRB
SCHEMBL2169375 0.82 THRA (0.46) THRATHRB
SCHEMBL16496709 0.81 THRA (0.43) THRATHRB
SCHEMBL2171593 0.81 THRA (0.43) THRATHRB
SCHEMBL16496483 0.78 THRB (0.37) THRATHRBLMNAKMT2A
SCHEMBL2169568 0.78 THRB (0.37) THRATHRBLMNAKMT2A

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20110301200-A1 THYROID RECEPTOR LIGANDS CADILA HEALTHCARE LIMITED (IN) 2011-12-08 US disclosed
EP-2346814-A2 THYROID RECEPTOR LIGANDS Cadila Healthcare Limited (IN) 2011-07-27 EP 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-20110301200-A1 THYROID RECEPTOR LIGANDS TSHR, THRB, THRA THRA 3/4885THRB 2/4885MEN1 1352/4885

“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.