SCHEMBL5418196

SCHEMBL5418196

COOc1ccc2c(Oc3ccc(OCCN4CCCCC4)cc3)c(OS(=O)(=O)C(F)(F)F)ccc2c1

nearest known ligand 0.49

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
ESR1 P03372 19/20 0.49
ESR2 Q92731 17/20 0.49
LTA4H P09960 1/20 0.42

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
SCHEMBL1359779 0.93 ESR1 (0.51) ESR1ESR2
SCHEMBL1359072 0.93 ESR1 (0.51) ESR1ESR2
Hydrochloric Acid SCHEMBL2183048 0.92 ESR1 (0.51) ESR1ESR2
SCHEMBL1359755 0.88 ESR1 (0.50) ESR1ESR2
SCHEMBL2180952 0.88 ESR1 (0.62) ESR1ESR2
SCHEMBL3115415 0.86 LTA4H (0.52) ESR1ESR2LTA4H
SCHEMBL1358434 0.79 ESR1 (0.51) ESR1ESR2LTA4H
SCHEMBL1358193 0.79 ESR1 (0.54) ESR1ESR2LTA4H
SCHEMBL1358420 0.79 ESR1 (0.54) ESR1ESR2LTA4H
SCHEMBL2906308 0.78 ESR1 (0.35) ESR1ESR2

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-20070111988-A1 Selective estrogen receptor modulators ELI LILLY AND COMPANY (US) 2007-05-17 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-20070111988-A1 Selective estrogen receptor modulators ESR2, GPER1, ESRRA ESR1 5/4885ESR2 1/4885LTA4H 1532/4885

“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.