SCHEMBL4817111

SCHEMBL4817111

COC(=O)C(Cl)Cc1cc(Br)c(O)c(Br)c1

nearest known ligand 0.40

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
FOLH1 Q04609 1/20 0.40
ESR1 P03372 2/20 0.39
TRPV1 Q8NER1 1/20 0.39
THRB P10828 5/20 0.37
PTPN1 P18031 2/20 0.37
ESR2 Q92731 1/20 0.36
THRA P10827 4/20 0.36
GAA P10253 1/20 0.36
MAPT P10636 1/20 0.36
PKM P14618 1/20 0.36
PPARG P37231 1/20 0.36
POLB P06746 2/20 0.35
MEN1 O00255 1/20 0.35
KMT2A Q03164 1/20 0.35
TTR P02766 1/20 0.35
HDAC1 Q13547 2/20 0.35
HDAC6 Q9UBN7 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
SCHEMBL14314184 0.85 PTPN1 (0.38) ESR1TRPV1THRBPTPN1THRA
SCHEMBL2164006 0.82 FOLH1 (0.41) FOLH1ESR1TRPV1THRBPTPN1
SCHEMBL3911299 0.82 FOLH1 (0.41) FOLH1ESR1TRPV1THRBPTPN1
SCHEMBL14540741 0.82 FOLH1 (0.41) FOLH1ESR1TRPV1THRBPTPN1
SCHEMBL3137725 0.82 FOLH1 (0.41) FOLH1ESR1TRPV1THRBPTPN1
SCHEMBL6374059 0.81 THRB (0.47) FOLH1ESR1TRPV1THRBTHRA
SCHEMBL7275974 0.81 THRB (0.47) FOLH1ESR1TRPV1THRBTHRA
SCHEMBL18822126 0.81 THRB (0.47) FOLH1ESR1TRPV1THRBTHRA
SCHEMBL3956951 0.79 FOLH1 (0.45) FOLH1ESR1TRPV1PTPN1POLB
SCHEMBL15931386 0.77 HDAC1 (0.35) ESR1ESR2GAAMEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20080027096-A1 Novel Pharmaceutical Compositions KARO BIO AB (SE) 2008-01-31 US disclosed
US-7319096-B2 Thyroid hormone receptor antagonists for cardiac and metabolic disorders II KARO BIO AB (SE) 2008-01-15 US disclosed
EP-1729756-A2 NOVEL PHARMACEUTICAL COMPOSITIONS KARO BIO AB (SE) 2006-12-13 EP disclosed
WO-2005094810-A2 NOVEL PHARMACEUTICAL COMPOSITIONS KARO BIO AB (SE) 2005-10-13 WO disclosed
US-20040220147-A1 Thyroid hormone receptor antagonists for cardiac and metabolic disorders ll KARO BIO AB (SE) 2004-11-04 US disclosed
EP-1387825-A1 THYROID HORMONE RECEPTOR ANTAGONISTS FOR CARDIAC & METABOLIC DISORDERS II KARO BIO AB (SE) 2004-02-11 EP disclosed
WO-2002092550-A1 THYROID HORMONE RECEPTOR ANTAGONISTS FOR CARDIAC AND METABOLIC DISORDERS II KARO BIO AB (SE) 2002-11-21 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 (2 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-20080027096-A1 Novel Pharmaceutical Compositions AR, NR5A1, CYP17A1 FOLH1 582/4885ESR1 58/4885TRPV1 265/4885
US-20040220147-A1 Thyroid hormone receptor antagonists for cardiac and metabolic disorders ll TSHR, TRHR, THRA FOLH1 3352/4885ESR1 635/4885TRPV1 1126/4885

“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.