SCHEMBL18845484

SCHEMBL18845484

OCc1ccc2c(c1)CCC(c1ccccc1)=C2c1ccc(O)cc1

nearest known ligand 0.57

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
ESR1 P03372 16/20 0.57
ESR2 Q92731 10/20 0.57
EBP Q15125 1/20 0.43
SIGMAR1 Q99720 1/20 0.43
CYP26A1 O43174 1/20 0.43

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
SCHEMBL2814712 0.86 ESR1 (0.75) ESR1ESR2CYP26A1
SCHEMBL8386622 0.86 ESR1 (0.75) ESR1ESR2CYP26A1
SCHEMBL18845470 0.81 ESR1 (0.60) ESR1ESR2EBPSIGMAR1CYP26A1
SCHEMBL20234951 0.81 ESR1 (0.57) ESR1EBPSIGMAR1
SCHEMBL18815872 0.80 ESR1 (0.69) ESR1ESR2EBPSIGMAR1
SCHEMBL14289688 0.80 ESR1 (0.60) ESR1ESR2
SCHEMBL2817611 0.78 ESR1 (0.86) ESR1ESR2EBPSIGMAR1CYP26A1
SCHEMBL3652303 0.78 ESR1 (0.79) ESR1ESR2
SCHEMBL27256081 0.78 S1PR1 (0.40) ESR1ESR2CYP26A1
SCHEMBL27256083 0.77 ESR1 (0.55) ESR1ESR2EBPSIGMAR1CYP26A1

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-20170129855-A1 TETRAHYDRONAPHTHALENE ESTROGEN RECEPTOR MODULATORS AND USES THEREOF GENENTECH, INC. (US) 2017-05-11 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-20170129855-A1 TETRAHYDRONAPHTHALENE ESTROGEN RECEPTOR MODULATORS AND USES THEREOF GPER1, ESR2, ESR1 ESR1 3/4885ESR2 2/4885EBP 152/4885

“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.