SCHEMBL5385576

SCHEMBL5385576

CCc1c(OC(=O)C=Cc2ccccc2)cc(Cl)c(Oc2ccc(N)cc2)c1Cl

nearest known ligand 0.41

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 3/20 0.41
HTR1A P08908 1/20 0.39
L3MBTL1 Q9Y468 2/20 0.39
LMNA P02545 1/20 0.39
KDM4E B2RXH2 2/20 0.39
ESR1 P03372 4/20 0.37
ESR2 Q92731 2/20 0.37
CYP1B1 Q16678 1/20 0.37
MAPT P10636 1/20 0.36
MAOA P21397 1/20 0.36
MAOB P27338 1/20 0.36
PIK3C3 Q8NEB9 1/20 0.36

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
SCHEMBL5385509 0.88 HTR1A (0.39) KMT2AHTR1AL3MBTL1LMNAKDM4E
SCHEMBL5389361 0.87 CYP1B1 (0.41) KMT2ACYP1B1MAPTMAOAMAOB
SCHEMBL5393470 0.82 KMT2A (0.41) KMT2AHTR1AL3MBTL1LMNAKDM4E
SCHEMBL5381978 0.80 ALOX15 (0.36) KMT2AKDM4EESR1MAPTMAOA
SCHEMBL5385273 0.79 THRB (0.54) KMT2AHTR1AL3MBTL1LMNAKDM4E
SCHEMBL5385626 0.79 THRB (0.49) KMT2AHTR1AL3MBTL1LMNAKDM4E
SCHEMBL5089442 0.73 KMT2A (0.71) KMT2AHTR1ALMNAKDM4EESR1
SCHEMBL14543843 0.72 CYP3A4 (0.48) L3MBTL1LMNAESR1MAPTMAOA
SCHEMBL14519768 0.72 CYP3A4 (0.48) L3MBTL1LMNAESR1MAPTMAOA
SCHEMBL5391906 0.71 LMNA (0.42) KMT2AHTR1AL3MBTL1LMNAKDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7199265-B2 Thyroid receptor ligands, pharmaceutical compositions comprising them and their use in the treatment of disorders influenced by thyroid hormones KARO BIO AB (SE) 2007-04-03 US disclosed
US-20040097589-A1 Thyroid receptor ligands, pharmaceutical compositions comprising them and their use in the treatment of disorders influenced by thyroid hormones KARO BIO AB (SE) 2004-05-20 US disclosed
EP-1296936-A1 THYROID RECEPTOR LIGANDS, PHARMACEUTICAL COMPOSITIONS COMPRISING THEM AND THEIR USE IN THE TREATMENT OF DISORDERS INFLUENCED BY THYROID HORMONES KARO BIO AB (SE) 2003-04-02 EP disclosed
WO-2001098256-A1 THYROID RECEPTOR LIGANDS, PHARMACEUTICAL COMPOSITIONS COMPRISING THEM AND THEIR USE IN THE TREATMENT OF DISORDERS INFLUENCED BY THYROID HORMONES KARO BIO AB (SE) 2001-12-27 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 (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-20040097589-A1 Thyroid receptor ligands, pharmaceutical compositions comprising them and their use in the treatment of disorders influenced by thyroid hormones TSHR, THRA, THRB KMT2A 4239/4885HTR1A 397/4885L3MBTL1 4655/4885

“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.