SCHEMBL5726861

SCHEMBL5726861

Oc1ccc(C(CCCl)=C(c2ccccc2)c2ccc(OCCOCc3ccccc3)cc2)cc1

nearest known ligand 0.72

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ ESR1 P03372 18/20 0.72
▸ CYP19A1 P11511 7/20 0.72
▸ ESR2 Q92731 6/20 0.72
▸ ESRRG P62508 12/20 0.68
▸ LMNA P02545 1/20 0.60
▸ HTR6 P50406 1/20 0.60
▸ CYP1A2 P05177 1/20 0.52
▸ CYP3A4 P08684 1/20 0.52
▸ CYP2A6 P11509 1/20 0.52
▸ CYP3A5 P20815 1/20 0.52
▸ ESRRB O95718 2/20 0.52

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
SCHEMBL5726853 1.00 ESR1 (0.72) ESR1CYP19A1ESR2ESRRGLMNA
SCHEMBL5727007 0.96 ESR1 (0.66) ESR1CYP19A1ESR2ESRRGLMNA
SCHEMBL7109996 0.96 ESR1 (0.66) ESR1CYP19A1ESR2ESRRGLMNA
SCHEMBL7109988 0.96 ESR1 (0.66) ESR1CYP19A1ESR2ESRRGLMNA
SCHEMBL7519055 0.96 ESR1 (0.66) ESR1CYP19A1ESR2ESRRGLMNA
SCHEMBL6373219 0.95 ESR1 (0.65) ESR1CYP19A1ESR2ESRRGLMNA
Hydrochloric Acid SCHEMBL7205293 0.95 ESR1 (0.65) ESR1CYP19A1ESR2ESRRGLMNA
SCHEMBL6373225 0.95 ESR1 (0.65) ESR1CYP19A1ESR2ESRRGLMNA
SCHEMBL6374444 0.95 ESR1 (0.65) ESR1CYP19A1ESR2ESRRGLMNA
SCHEMBL8362771 0.94 ESR1 (0.63) ESR1CYP19A1ESR2ESRRGLMNA

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
EP-1705169-A2 Triphenylalkene derivatives and their use as selective estrogen receptor modulators Hormos Medical Ltd. (FI) 2006-09-27 — — EP disclosed
EP-1235776-B1 TRIPHENYLALKENE DERIVATIVES AND THEIR USE AS SELECTIVE ESTROGEN RECEPTOR MODULATORS HORMOS MEDICAL CORP (FI) 2006-02-08 — — EP disclosed
US-6875775-B2 Triphenylalkene derivatives and their use as selective estrogen receptor modulators HORMOS MEDICAL OY LTD (FI) 2005-04-05 — — US disclosed
US-20030225130-A1 Triphenylalkene derivatives and their use as selective estrogen receptor modulators HORMOS MEDICAL OY LTD. 2003-12-04 — — US disclosed
US-6576645-B1 Such as 3-(4-chloro-1-(4-(2-(2-hydroxyethoxy)ethoxy)phenyl)--2-phenylbut-1 -enyl)phenol; producing tissue specific estro-genic and/or antiestrogenic effect HORMOS MEDICAL OY LTD (FI) 2003-06-10 — — 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-20030225130-A1 Triphenylalkene derivatives and their use as selective estrogen receptor modulators ESR2, ESR1, GPER1 ESR1 2/4885CYP19A1 11/4885ESR2 1/4885

“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.

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