SCHEMBL23977206

SCHEMBL23977206

OC[C@H]1CC[C@@H](c2ccc(O)cc2)CC1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
ESR2 Q92731 20/20 1.00
ESR1 P03372 8/20 1.00
CYP3A4 P08684 2/20 1.00
CYP2C9 P11712 2/20 1.00
CYP2D6 P10635 1/20 0.86

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
SCHEMBL20524202 1.00 ESR2 (1.00) ESR2ESR1CYP3A4CYP2C9CYP2D6
SCHEMBL18244747 1.00 ESR2 (1.00) ESR2ESR1CYP3A4CYP2C9CYP2D6
SCHEMBL18257874 0.93 ESR2 (1.00) ESR2ESR1CYP3A4CYP2C9CYP2D6
SCHEMBL18257870 0.93 ESR2 (1.00) ESR2ESR1CYP3A4CYP2C9CYP2D6
SCHEMBL18257841 0.93 ESR2 (1.00) ESR2ESR1CYP3A4CYP2C9CYP2D6
SCHEMBL18257872 0.93 ESR2 (1.00) ESR2ESR1CYP3A4CYP2C9CYP2D6
Hydroquinone SCHEMBL408939 0.87 ESR2 (0.75) ESR2ESR1CYP3A4CYP2C9CYP2D6
SCHEMBL1865798 0.84 ESR2 (0.81) ESR2ESR1CYP3A4CYP2C9CYP2D6
SCHEMBL1986271 0.84 ESR2 (0.81) ESR2ESR1CYP3A4CYP2C9CYP2D6
SCHEMBL3811445 0.84 ESR2 (0.81) ESR2ESR1CYP3A4CYP2C9CYP2D6

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-20210340155-A1 Substituted (4-Hydroxyphenyl)Cycloalkane and (4-Hydroxyphenyl)Cycloalkene Compounds and Uses Thereof as Selective Agonists of the Estrogen Receptor Beta Isoform for Enhanced Memory Consolidation CU Ventures, Inc. 2021-11-04 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-20210340155-A1 Substituted (4-Hydroxyphenyl)Cycloalkane and (4-Hydroxyphenyl)Cycloalkene Compounds and Uses Thereof as Selective Agonists of the Estrogen Receptor Beta Isoform for Enhanced Memory Consolidation ESR2, GPER1, ESR1 ESR2 1/4885ESR1 3/4885CYP3A4 1012/4885

“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.