SCHEMBL2718702

SCHEMBL2718702

CCc1cc(C2C=CC(c3ccc(O)cc3)CC2)ccc1O

nearest known ligand 0.41

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
ESR2 Q92731 7/20 0.40
ESR1 P03372 4/20 0.40
BACE1 P56817 1/20 0.38
HSD17B1 P14061 2/20 0.36
HSP90AA1 P07900 1/20 0.36
HSP90AB1 P08238 1/20 0.36
CYP19A1 P11511 2/20 0.34
PTPN1 P18031 1/20 0.34
ALDH1A1 P00352 1/20 0.33
GAA P10253 1/20 0.33

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
SCHEMBL4223410 0.88 ESR2 (0.39) ESR2ESR1
SCHEMBL4216547 0.85 TYR (0.46) ESR2ESR1ALDH1A1GAA
SCHEMBL4216531 0.84 TYR (0.47) ESR2ESR1ALDH1A1
SCHEMBL4209515 0.83 TYR (0.49) ESR2ESR1ALDH1A1
SCHEMBL4220075 0.83 TYR (0.49) ESR2ESR1ALDH1A1
SCHEMBL4220658 0.83 TYR (0.49) ESR2ESR1ALDH1A1
SCHEMBL2721166 0.81 ESR2 (0.53) ESR2ESR1
SCHEMBL2717694 0.80 SHBG (0.40) ESR2ESR1
SCHEMBL2718567 0.79 ESR2 (0.41) ESR2ESR1BACE1HSD17B1ALDH1A1
SCHEMBL4217711 0.79 ESR1 (0.43) ESR2ESR1BACE1HSD17B1HSP90AA1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1995245-B1 METHOD FOR PRODUCING EPOXY COMPOUND SUMITOMO CHEMICAL CO (JP) 2012-05-02 EP disclosed
CN-101400665-A Method for producing epoxy compound SUMITOMO CHEMICAL CO (JP) 2009-04-01 CN disclosed
US-20090054669-A1 Process For Producing Epoxy Compound SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2009-02-26 US disclosed
EP-1995245-A1 METHOD FOR PRODUCING EPOXY COMPOUND Sumitomo Chemical Company, Limited (JP) 2008-11-26 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-20090054669-A1 Process For Producing Epoxy Compound RER1, AR, CYP1A1 ESR2 4/4885ESR1 11/4885BACE1 3292/4885

“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.