SCHEMBL5069462

SCHEMBL5069462

CCC(=C(c1ccc(O)cc1)c1ccc(C=O)cc1)c1ccccc1

nearest known ligand 0.76

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
ESR1 P03372 16/20 0.76
ESR2 Q92731 10/20 0.76
CYP19A1 P11511 4/20 0.76
PGR P06401 2/20 0.71
PTGS2 P35354 1/20 0.63

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
SCHEMBL5069452 1.00 ESR1 (0.76) ESR1ESR2CYP19A1PGRPTGS2
SCHEMBL5069457 1.00 ESR1 (0.76) ESR1ESR2CYP19A1PGRPTGS2
SCHEMBL5124519 0.94 ESR1 (0.68) ESR1ESR2CYP19A1PGRPTGS2
SCHEMBL5124515 0.94 ESR1 (0.68) ESR1ESR2CYP19A1PGRPTGS2
SCHEMBL5124512 0.94 ESR1 (0.68) ESR1ESR2CYP19A1PGRPTGS2
SCHEMBL23851086 0.87 ESR1 (1.00) ESR1ESR2CYP19A1PGRPTGS2
SCHEMBL5818558 0.87 ESR1 (1.00) ESR1ESR2CYP19A1PGRPTGS2
SCHEMBL5354177 0.87 ESR1 (1.00) ESR1ESR2CYP19A1PGRPTGS2
SCHEMBL7723356 0.87 ESR1 (1.00) ESR1ESR2CYP19A1PGRPTGS2
SCHEMBL639225 0.87 ESR1 (1.00) ESR1ESR2CYP19A1PGRPTGS2

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-7442833-B2 Triphenylethylene compounds as selective estrogen receptor modulators SMITHKLINE BEECHAM CORPORATION (US) 2008-10-28 US disclosed
EP-1692127-B1 TRIPHENYLETHYLENE COMPOUNDS AS SELECTIVE ESTROGEN RECEPTOR MODULATORS SMITHKLINE BEECHAM CORP (US) 2008-07-02 EP disclosed
US-20070111971-A1 Novel compounds SMITHKLINE BEECHAM CORPORATION 2007-05-17 US disclosed
EP-1692127-A2 TRIPHENYLETHYLENE COMPOUNDS AS SELECTIVE ESTROGEN RECEPTOR MODULATORS SMITHKLINE BEECHAM CORPORATION (US) 2006-08-23 EP disclosed
WO-2005033056-A2 TRIPHENYLETHYLENE COMPOUNDS AS SELECTIVE ESTROGEN RECEPTOR MODULATORS SMITHKLINE BEECHAM CORPORATION (US) 2005-04-14 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-20070111971-A1 Novel compounds GPER1, ESR2, ESR1 ESR1 3/4885ESR2 2/4885CYP19A1 4/4885

“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.