SCHEMBL8166120

SCHEMBL8166120

COc1cc(/C=C2\SC(NCCF)=NC2=O)ccc1Oc1ccc(C#N)cc1C(F)(F)F

nearest known ligand 0.65

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
ESRRA P11474 20/20 0.65
ESRRB O95718 1/20 0.65
ESR1 P03372 1/20 0.65
ESRRG P62508 1/20 0.65
ESR2 Q92731 1/20 0.65
CYP3A4 P08684 4/20 0.47

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
SCHEMBL4442826 1.00 ESRRA (0.65) ESRRAESRRBESR1ESRRGESR2
SCHEMBL4442824 1.00 ESRRA (0.65) ESRRAESRRBESR1ESRRGESR2
SCHEMBL8161227 0.94 ESRRA (0.62) ESRRAESRRBESR1ESRRGESR2
SCHEMBL4430537 0.94 ESRRA (0.62) ESRRAESRRBESR1ESRRGESR2
SCHEMBL4430535 0.94 ESRRA (0.62) ESRRAESRRBESR1ESRRGESR2
Hydrochloric Acid SCHEMBL4990170 0.94 ESRRA (0.61) ESRRAESRRBESR1ESRRGESR2
Hydrochloric Acid SCHEMBL4990166 0.94 ESRRA (0.61) ESRRAESRRBESR1ESRRGESR2
SCHEMBL8159632 0.93 ESRRA (0.62) ESRRAESRRBESR1ESRRGESR2
SCHEMBL4432027 0.93 ESRRA (0.62) ESRRAESRRBESR1ESRRGESR2
SCHEMBL4435432 0.93 ESRRA (0.62) ESRRAESRRBESR1ESRRGESR2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8580832-B2 Substituted phenoxy aminothiazolones as estrogen related receptor-α modulators JANSSEN PHARMACEUTICA N.V. (BE) 2013-11-12 US disclosed
US-8580832-B2 Substituted phenoxy aminothiazolones as estrogen related receptor-α modulators JANSSEN PHARMACEUTICA N.V. (BE) 2013-11-12 US disclosed
WO-2008109737-A1 SUBSTITUTED PHENOXY AMINOTHIAZOLONES AS ESTROGEN RELATED RECEPTOR-ALPHA MODULATORS JANSSEN PHARMACEUTICA N.V. (BE) 2008-09-12 WO disclosed
US-20080221179-A1 SUBSTITUTED PHENOXY AMINOTHIAZOLONES as estrogen related receptor-alpha modulators JANSSEN PHARMACEUTICA N.V. (BE) 2008-09-11 US disclosed
US-20080221179-A1 SUBSTITUTED PHENOXY AMINOTHIAZOLONES as estrogen related receptor-alpha modulators JANSSEN PHARMACEUTICA N.V. (BE) 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-20080221179-A1 SUBSTITUTED PHENOXY AMINOTHIAZOLONES as estrogen related receptor-alpha modulators ESR2, ESRRA, ESRRG ESRRA 2/4885ESRRB 4/4885ESR1 7/4885

“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.