SCHEMBL4891913

SCHEMBL4891913

CCCC(=C(c1ccc(O)cc1)c1ccc(O)cc1)c1cccc(OC(CC)C(=O)O)c1

nearest known ligand 0.56

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
ESR1 P03372 14/20 0.56
ESR2 Q92731 3/20 0.50
CYP19A1 P11511 3/20 0.49
ESRRB O95718 1/20 0.46
SMN1; SMN2 Q16637 1/20 0.44
PTGS2 P35354 1/20 0.42
PPARG P37231 1/20 0.42
PPARA Q07869 1/20 0.42
FOLH1 Q04609 1/20 0.42

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
SCHEMBL4886143 0.93 ESR1 (0.57) ESR1ESR2ESRRBPTGS2FOLH1
SCHEMBL4887868 0.91 ESR1 (0.56) ESR1ESR2CYP19A1
SCHEMBL4667995 0.81 ESR1 (0.62) ESR1ESR2CYP19A1
SCHEMBL4897738 0.80 SMN1; SMN2 (0.52) SMN1; SMN2PPARGPPARAFOLH1
SCHEMBL4667736 0.79 ESR1 (0.58) ESR1ESR2CYP19A1
SCHEMBL4665856 0.76 CYP19A1 (0.60) ESR1ESR2CYP19A1ESRRB
SCHEMBL2556069 0.76 SMN1; SMN2 (0.56) SMN1; SMN2PPARGPPARAFOLH1
SCHEMBL4796083 0.75 ESR1 (0.53) ESR1ESR2CYP19A1
SCHEMBL4665812 0.74 ESR1 (0.60) ESR1ESR2CYP19A1PTGS2PPARG
SCHEMBL4895944 0.74 SMN1; SMN2 (0.55) SMN1; SMN2PPARGPPARAFOLH1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20080255078-A1 Triphenylethylene Compounds Useful as Selective Estrogen Receptor Modulators KATAMREDDY SUBBA REDDY 2008-10-16 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-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.