SCHEMBL14675129

SCHEMBL14675129

C=C(C)Cc1c(C#N)cc(CCC)cc1-c1ccc(O)cc1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ESR2 Q92731 5/20 0.38
CYP19A1 P11511 2/20 0.37
USP7 Q93009 5/20 0.37
ESR1 P03372 6/20 0.35
CNR1 P21554 1/20 0.34
CNR2 P34972 1/20 0.34
ALOX5 P09917 1/20 0.34
PDE3B Q13370 1/20 0.34
PDE3A Q14432 1/20 0.34
PPARG P37231 2/20 0.33
AR P10275 1/20 0.32
KDM4E B2RXH2 1/20 0.31
ALDH1A1 P00352 1/20 0.31
LMNA P02545 1/20 0.31
SHBG P04278 1/20 0.31
TP53 P04637 1/20 0.31
CYP3A4 P08684 1/20 0.31
ADRA2A P08913 1/20 0.31
ADORA3 P0DMS8 1/20 0.31
HSPD1 P10809 1/20 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
SCHEMBL14685341 0.81 GABRA1 (0.43) ESR2USP7ESR1CNR1CNR2
SCHEMBL14675581 0.79 ESR2 (0.41) ESR2CYP19A1USP7ESR1CNR1
SCHEMBL14675564 0.78 ESR2 (0.43) ESR2CYP19A1USP7ESR1CNR1
SCHEMBL14675169 0.78 USP7 (0.46) ESR2CYP19A1USP7ESR1CNR1
SCHEMBL16193775 0.78 ESR1 (0.43) ESR2CYP19A1USP7ESR1CNR1
SCHEMBL21141749 0.75 ESR1 (0.33) USP7ESR1CNR1CNR2ALOX5
SCHEMBL16194112 0.75 USP7 (0.34) ESR2USP7ESR1CNR1CNR2
SCHEMBL16194114 0.75 USP7 (0.34) ESR2USP7ESR1CNR1CNR2
SCHEMBL16193768 0.75 ESR2 (0.47) ESR2CYP19A1USP7PDE3BPDE3A
SCHEMBL28146428 0.72 PTGS2 (0.45) ESR2CYP19A1USP7ESR1KDM4E

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 ESR2 4/4885CYP19A1 11/4885USP7 1983/4885
US-20140323518-A1 NOVEL ESTROGEN RECEPTOR LIGANDS ESR1, ESRRA, GPER1 ESR2 4/4885CYP19A1 11/4885USP7 1983/4885

“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.