SCHEMBL4922928

SCHEMBL4922928

CCNc1cc(C)cc(COc2c(Br)cc(CC(F)C(=O)O)cc2Br)c1

nearest known ligand 0.50

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
THRB P10828 15/20 0.50
THRA P10827 14/20 0.50
FFAR1 O14842 2/20 0.36
MAPT P10636 2/20 0.34
TP53 P04637 1/20 0.34
GAA P10253 1/20 0.34
ESR1 P03372 1/20 0.34
NR3C1 P04150 1/20 0.34
PGR P06401 1/20 0.34
NR3C2 P08235 1/20 0.34
AR P10275 1/20 0.34
LMNA P02545 1/20 0.34
NPSR1 Q6W5P4 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.33

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
SCHEMBL4931744 0.93 THRB (0.42) THRBTHRAFFAR1MAPTTP53
SCHEMBL4931582 0.89 FFAR1 (0.39) THRBTHRAFFAR1MAPTTP53
SCHEMBL4356850 0.89 THRB (0.50) THRBTHRAFFAR1MAPTTP53
SCHEMBL4926936 0.89 THRB (0.43) THRBTHRAFFAR1ESR1NR3C1
SCHEMBL5111457 0.87 THRB (0.40) THRBTHRAFFAR1
SCHEMBL5116750 0.87 THRB (0.42) THRBTHRAFFAR1ESR1NR3C1
SCHEMBL4934394 0.87 THRB (0.42) THRBTHRAFFAR1ESR1NR3C1
SCHEMBL4924786 0.87 THRA (0.39) THRBTHRAFFAR1MAPTLMNA
SCHEMBL5110522 0.86 THRB (0.40) THRBTHRAFFAR1ESR1NR3C1
SCHEMBL4932946 0.86 MEN1 (0.40) THRBTHRAFFAR1

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 THRB 4/4885THRA 3/4885FFAR1 37/4885

“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.