SCHEMBL4668912

SCHEMBL4668912

CCC(=C(c1ccc(O)cc1)c1ccc(O)cc1)c1cccc(C(=O)O)c1

nearest known ligand 0.68

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
ESR1 P03372 13/20 0.68
ESR2 Q92731 6/20 0.68
CYP19A1 P11511 6/20 0.68
PTGS2 P35354 1/20 0.57
PGR P06401 1/20 0.57

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
SCHEMBL9556424 0.87 ESR1 (0.83) ESR1ESR2CYP19A1PTGS2PGR
SCHEMBL9451158 0.87 ESR1 (0.83) ESR1ESR2CYP19A1PTGS2PGR
SCHEMBL3811247 0.85 ESR1 (0.78) ESR1ESR2CYP19A1PTGS2PGR
SCHEMBL14532057 0.84 ESR1 (0.68) ESR1ESR2CYP19A1PTGS2PGR
SCHEMBL23851086 0.81 ESR1 (1.00) ESR1ESR2CYP19A1PTGS2PGR
SCHEMBL7723356 0.81 ESR1 (1.00) ESR1ESR2CYP19A1PTGS2PGR
SCHEMBL5354177 0.81 ESR1 (1.00) ESR1ESR2CYP19A1PTGS2PGR
SCHEMBL639225 0.81 ESR1 (1.00) ESR1ESR2CYP19A1PTGS2PGR
SCHEMBL5354173 0.81 ESR1 (1.00) ESR1ESR2CYP19A1PTGS2PGR
SCHEMBL5818558 0.81 ESR1 (1.00) ESR1ESR2CYP19A1PTGS2PGR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1951216-A2 CHEMICAL COMPOUNDS SmithKline Beecham Corporation (US) 2008-08-06 EP claimed
WO-2007062145-A2 CHEMICAL COMPOUNDS SMITHKLINE BEECHAM CORPORATION (US) 2007-05-31 WO claimed
US-20080255078-A1 Triphenylethylene Compounds Useful as Selective Estrogen Receptor Modulators KATAMREDDY SUBBA REDDY 2008-10-16 US disclosed
US-20080255078-A1 Triphenylethylene Compounds Useful as Selective Estrogen Receptor Modulators KATAMREDDY SUBBA REDDY 2008-10-16 US disclosed
US-20080255078-A1 Triphenylethylene Compounds Useful as Selective Estrogen Receptor Modulators KATAMREDDY SUBBA REDDY 2008-10-16 US disclosed
EP-1951216-A2 CHEMICAL COMPOUNDS SmithKline Beecham Corporation (US) 2008-08-06 EP disclosed
WO-2007062145-A2 CHEMICAL COMPOUNDS SMITHKLINE BEECHAM CORPORATION (US) 2007-05-31 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-20080255078-A1 Triphenylethylene Compounds Useful as Selective Estrogen Receptor Modulators GPER1, ESR2, ESRRG ESR1 4/4885ESR2 2/4885CYP19A1 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.