SCHEMBL5075271

SCHEMBL5075271

CCCCC(=C(c1ccc(OC(=O)C(C)(C)C)cc1)c1ccc(OC(=O)C(C)(C)C)cc1)c1ccc(O)cc1

nearest known ligand 0.66

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
ESR1 P03372 4/20 0.66
ESR2 Q92731 2/20 0.66
ELANE P08246 7/20 0.58
PTGS2 P35354 4/20 0.52
ESRRG P62508 2/20 0.52
HSD17B3 P37058 1/20 0.48

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
SCHEMBL5073334 0.84 ESRRB (0.60) ESR1ESR2ESRRG
SCHEMBL20836458 0.83 ESRRB (0.60) ESR1ESR2ELANEESRRG
SCHEMBL5011583 0.82 ESR1 (0.62) ESR1ESR2PTGS2HSD17B3
SCHEMBL639545 0.82 ESR1 (0.67) ESR1ESR2ELANEESRRG
SCHEMBL21956602 0.82 ESR1 (0.67) ESR1ESR2ELANEESRRG
SCHEMBL639544 0.82 ESR1 (0.67) ESR1ESR2ELANEESRRG
SCHEMBL5082218 0.81 PSMB1 (0.64) ESR1ESRRG
SCHEMBL31061702 0.81 ESR1 (1.00) ESR1ESR2PTGS2ESRRGHSD17B3
SCHEMBL3827799 0.79 ESR1 (0.70) ESR1ESR2PTGS2ESRRG
SCHEMBL14088321 0.79 ESR1 (0.81) ESR1ESR2PTGS2HSD17B3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20080255089-A1 Menopausal or postmenopausal disorders, vasomotor symptoms, urogenital disorders, female sexual dysfunction, breast cancer, depression, diabetes, bone demineralization, and osteoporosis; substituted 2-(p-aminoalkoxyphenyl)-1,1-diphenylethylene derivatives SMITHKLINE BEECHAM CORPORATION 2008-10-16 US disclosed
EP-1951250-A2 CHEMICAL COMPOUNDS SmithKline Beecham Corporation (US) 2008-08-06 EP disclosed
WO-2007062151-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-20080255089-A1 Menopausal or postmenopausal disorders, vasomotor symptoms, urogenital disorders, female sexual dysfunction, breast cancer, depression, diabetes, bone demineralization, and osteoporosis; substituted 2-(p-aminoalkoxyphenyl)-1,1-diphenylethylene derivatives SHBG, ESR1, GPER1 ESR1 2/4885ESR2 4/4885ELANE 3404/4885

“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.