SCHEMBL4934563

SCHEMBL4934563

O=C(O)Cc1cc(Cl)c(OCc2cccc(NC3CCC3)c2)c(Cl)c1

nearest known ligand 0.43

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
PTPN1 P18031 5/20 0.43
THRB P10828 4/20 0.42
THRA P10827 3/20 0.42
KDM4E B2RXH2 1/20 0.41
MEN1 O00255 1/20 0.41
ALDH1A1 P00352 1/20 0.41
OPRK1 P41145 1/20 0.41
KMT2A Q03164 1/20 0.41
MRGPRX4 Q96LA9 4/20 0.41
RXRB P28702 1/20 0.39
EPHX2 P34913 1/20 0.38
PDE5A O76074 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
SCHEMBL5717926 0.91 PTPN1 (0.39) PTPN1KDM4EMEN1ALDH1A1OPRK1
SCHEMBL4927550 0.89 THRB (0.53) PTPN1THRBTHRA
SCHEMBL4357988 0.85 THRA (0.55) THRBTHRA
SCHEMBL4934576 0.85 KMT2A (0.40) THRBTHRAKDM4EMEN1ALDH1A1
SCHEMBL4935259 0.85 THRB (0.39) THRBTHRAKDM4EMEN1ALDH1A1
SCHEMBL4932680 0.85 MRGPRX4 (0.42) PTPN1MEN1ALDH1A1KMT2AMRGPRX4
SCHEMBL4932229 0.82 PPARD (0.43) THRBTHRAMRGPRX4RXRB
SCHEMBL5717931 0.82 MRGPRX4 (0.40) PTPN1MEN1KMT2AMRGPRX4
SCHEMBL4929427 0.82 THRA (0.47) THRBTHRAKDM4EMEN1KMT2A
SCHEMBL4930325 0.81 THRA (0.45) THRBTHRAKMT2AMRGPRX4PDE5A

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 PTPN1 354/4885THRB 4/4885THRA 3/4885

“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.