SCHEMBL21260716

SCHEMBL21260716

Cc1ccccc1C(=O)c1sc2cc(O)ccc2c1-c1ccc(C2CC2C(=O)O)cc1

nearest known ligand 0.46

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ ESR1 P03372 17/20 0.46
▸ FFAR1 O14842 1/20 0.41
▸ ESR2 Q92731 1/20 0.40
▸ FFAR4 Q5NUL3 1/20 0.39

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
SCHEMBL21260866 0.92 ESR1 (0.50) ESR1FFAR1FFAR4
SCHEMBL21260893 0.90 ESR1 (0.47) ESR1FFAR1FFAR4
SCHEMBL21260868 0.89 ESR1 (0.50) ESR1FFAR1FFAR4
SCHEMBL21260863 0.89 ESR1 (0.45) ESR1FFAR1ESR2FFAR4
SCHEMBL21260718 0.88 ESR1 (0.53) ESR1FFAR4
SCHEMBL21260834 0.88 ESR1 (0.46) ESR1FFAR1ESR2FFAR4
SCHEMBL21243214 0.88 ESR1 (0.56) ESR1
SCHEMBL21260802 0.87 ESR1 (0.57) ESR1FFAR1ESR2FFAR4
SCHEMBL21260867 0.87 ESR1 (0.48) ESR1FFAR1FFAR4
SCHEMBL21260862 0.86 ESR1 (0.47) ESR1FFAR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10703747-B2 Benzothiophene-based selective mixed estrogen receptor downregulators The Board of Directors of the University of Illinois (US) 2020-07-07 — — US disclosed
US-20190248780-A1 BENZOTHIOPHENE-BASED SELECTIVE MIXED ESTROGEN RECEPTOR DOWNREGULATORS THE BOARD OF TRUSTEES OF THE UNIVERSITY OF ILLNOIS (US) 2019-08-15 — — 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 (2 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-20190248780-A1 BENZOTHIOPHENE-BASED SELECTIVE MIXED ESTROGEN RECEPTOR DOWNREGULATORS ESR1, ESR2, GPER1 ESR1 1/4885FFAR1 384/4885ESR2 2/4885
US-10703747-B2 Benzothiophene-based selective mixed estrogen receptor downregulators ESR1, ESR2, GPER1 ESR1 1/4885FFAR1 384/4885ESR2 2/4885

“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.

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