SCHEMBL14675666

SCHEMBL14675666

CCCc1cc(Br)c(I)c(C#N)c1

nearest known ligand 0.31

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.31
ALDH1A1 P00352 1/20 0.31
GAA P10253 1/20 0.31
HPGD P15428 1/20 0.31
L3MBTL1 Q9Y468 1/20 0.31
CTSS P25774 2/20 0.31
CTSK P43235 2/20 0.31

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
SCHEMBL14675271 0.81 ADRB2 (0.45) KDM4EALDH1A1GAAHPGDL3MBTL1
SCHEMBL2656380 0.81 CYP1A2 (0.31) KDM4EALDH1A1GAAHPGDL3MBTL1
SCHEMBL21168751 0.80
SCHEMBL28889526 0.77 ALDH1A1 (0.37) KDM4EALDH1A1GAAHPGDCTSS
SCHEMBL14675556 0.74 XDH (0.45) KDM4EALDH1A1GAAHPGDL3MBTL1
SCHEMBL14675564 0.72 ESR2 (0.43)
SCHEMBL14675623 0.70 CYP2A6 (0.33) ALDH1A1
SCHEMBL30084929 0.69 MAPT (0.41) KDM4EALDH1A1GAAHPGD
SCHEMBL28920164 0.69 MAPT (0.41) KDM4EALDH1A1GAAHPGD
SCHEMBL16874395 0.69 THRB (0.38)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2739609-B1 NOVEL ESTROGEN RECEPTOR LIGANDS KARO PHARMA AB (SE) 2019-07-17 EP disclosed
US-20170128434-A1 NOVEL ESTROGEN RECEPTOR LIGANDS KARO PHARMA AB (SE) 2017-05-11 US disclosed
US-20170128434-A1 NOVEL ESTROGEN RECEPTOR LIGANDS KARO PHARMA AB (SE) 2017-05-11 US disclosed
US-20170128434-A1 NOVEL ESTROGEN RECEPTOR LIGANDS KARO PHARMA AB (SE) 2017-05-11 US disclosed
US-9586891-B2 Estrogen receptor ligands KARO PHARMA AB (SE) 2017-03-07 US disclosed
US-9586891-B2 Estrogen receptor ligands KARO PHARMA AB (SE) 2017-03-07 US disclosed
US-9586891-B2 Estrogen receptor ligands KARO PHARMA AB (SE) 2017-03-07 US disclosed
US-20140323518-A1 NOVEL ESTROGEN RECEPTOR LIGANDS KARO PHARMA AB (SE) 2014-10-30 US disclosed
US-20140323518-A1 NOVEL ESTROGEN RECEPTOR LIGANDS KARO PHARMA AB (SE) 2014-10-30 US disclosed
US-20140323518-A1 NOVEL ESTROGEN RECEPTOR LIGANDS KARO PHARMA AB (SE) 2014-10-30 US disclosed
EP-2739609-A1 NOVEL ESTROGEN RECEPTOR LIGANDS KARO BIO AB (SE) 2014-06-11 EP disclosed
WO-2013017654-A1 NOVEL ESTROGEN RECEPTOR LIGANDS KARO BIO AB (SE) 2013-02-07 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-20170128434-A1 NOVEL ESTROGEN RECEPTOR LIGANDS ESR1, ESRRA, GPER1 KDM4E 443/4885ALDH1A1 1517/4885GAA 4304/4885
US-20140323518-A1 NOVEL ESTROGEN RECEPTOR LIGANDS ESR1, ESRRA, GPER1 KDM4E 443/4885ALDH1A1 1517/4885GAA 4304/4885

“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.