SCHEMBL4933102

SCHEMBL4933102

O=C(O)CCc1cc(Cl)c(OCc2cc(F)cc(NC3CCC3)c2)c(Cl)c1

nearest known ligand 0.43

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
ACLY P53396 1/20 0.43
THRA P10827 11/20 0.40
THRB P10828 11/20 0.40
ALDH1A1 P00352 1/20 0.38
HTT P42858 1/20 0.38
MAPT P10636 1/20 0.37
KMT2A Q03164 1/20 0.37
NPSR1 Q6W5P4 1/20 0.37
ESR1 P03372 1/20 0.37
NR3C1 P04150 1/20 0.37
PGR P06401 1/20 0.37
NR3C2 P08235 1/20 0.37
AR P10275 1/20 0.37
FFAR4 Q5NUL3 4/20 0.35
FFAR1 O14842 2/20 0.35

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
SCHEMBL4932351 0.90 THRA (0.53) ACLYTHRATHRBESR1NR3C1
SCHEMBL4935259 0.89 THRB (0.39) THRATHRBALDH1A1HTTMAPT
SCHEMBL4933366 0.89 THRA (0.45) THRATHRBALDH1A1KMT2AESR1
SCHEMBL4531944 0.88 THRA (0.45) THRATHRBALDH1A1KMT2AESR1
SCHEMBL4930094 0.87 THRA (0.48) THRATHRBFFAR4FFAR1
SCHEMBL4933093 0.85 FFAR4 (0.41) THRATHRBALDH1A1KMT2AESR1
SCHEMBL4931269 0.83 ACLY (0.43) ACLYTHRATHRBESR1NR3C1
SCHEMBL4931877 0.83 PDE4A (0.35) ALDH1A1HTTMAPTKMT2ANPSR1
SCHEMBL4931681 0.82 ACLY (0.47) ACLYTHRATHRBESR1NR3C1
SCHEMBL4933723 0.82 ACLY (0.45) ACLYTHRATHRBESR1NR3C1

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 ACLY 3298/4885THRA 3/4885THRB 4/4885

“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.