SCHEMBL2814712

SCHEMBL2814712

Oc1ccc(C2=C(c3ccccc3)CCc3cc(O)ccc32)cc1

nearest known ligand 0.75

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
ESR1 P03372 17/20 0.75
ESR2 Q92731 11/20 0.75
CYP26A1 O43174 1/20 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
SCHEMBL8386622 1.00 ESR1 (0.75) ESR1ESR2CYP26A1
SCHEMBL3652303 0.91 ESR1 (0.79) ESR1ESR2
SCHEMBL25511757 0.89 ESR1 (0.61) ESR1ESR2CYP26A1
SCHEMBL18845470 0.88 ESR1 (0.60) ESR1ESR2CYP26A1
SCHEMBL14289688 0.87 ESR1 (0.60) ESR1ESR2
SCHEMBL18845484 0.86 ESR1 (0.57) ESR1ESR2CYP26A1
SCHEMBL2817611 0.85 ESR1 (0.86) ESR1ESR2CYP26A1
SCHEMBL6438989 0.84 ESR1 (0.60) ESR1ESR2CYP26A1
SCHEMBL6438992 0.84 ESR1 (0.60) ESR1ESR2CYP26A1
SCHEMBL20211881 0.82 ESR1 (0.66) ESR1ESR2CYP26A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2192108-B1 Novel dihydronaphthalene compound and use thereof UNIV TOKYO SCI EDUC FOUND (JP) 2013-03-27 EP disclosed
US-8183235-B2 Dihydronaphthalene compound and use thereof TOKYO UNIVERSITY OF SCIENCE EDUCATIONAL FOUNDATION ADMINISTRATIVE ORGANIZATION (JP) 2012-05-22 US disclosed
US-8183235-B2 Dihydronaphthalene compound and use thereof TOKYO UNIVERSITY OF SCIENCE EDUCATIONAL FOUNDATION ADMINISTRATIVE ORGANIZATION (JP) 2012-05-22 US disclosed
US-8183235-B2 Dihydronaphthalene compound and use thereof TOKYO UNIVERSITY OF SCIENCE EDUCATIONAL FOUNDATION ADMINISTRATIVE ORGANIZATION (JP) 2012-05-22 US disclosed
US-20100249400-A1 NOVEL DIHYDRONAPHTHALENE COMPOUND AND USE THEREOF TOKYO UNIVERSITY OF SCIENCE EDUCATIONAL FOUNDATION ADMINISTRATIVE ORGANIZATION (JP) 2010-09-30 US disclosed
US-20100249400-A1 NOVEL DIHYDRONAPHTHALENE COMPOUND AND USE THEREOF TOKYO UNIVERSITY OF SCIENCE EDUCATIONAL FOUNDATION ADMINISTRATIVE ORGANIZATION (JP) 2010-09-30 US disclosed
US-20100249400-A1 NOVEL DIHYDRONAPHTHALENE COMPOUND AND USE THEREOF TOKYO UNIVERSITY OF SCIENCE EDUCATIONAL FOUNDATION ADMINISTRATIVE ORGANIZATION (JP) 2010-09-30 US disclosed
EP-2192108-A1 NOVEL DIHYDRONAPHTHALENE COMPOUND AND USE THEREOF Tokyo University Of Science Educational Foundation Administrative Organization (JP) 2010-06-02 EP 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-20100249400-A1 NOVEL DIHYDRONAPHTHALENE COMPOUND AND USE THEREOF PSME1, NDUFB1, NDUFB10 ESR1 142/4885ESR2 167/4885CYP26A1 1665/4885

“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.