SCHEMBL21260898

SCHEMBL21260898

Cc1ccccc1C(=O)c1sc2cc(O)ccc2c1-c1ccc(-c2nc(N)co2)cc1

nearest known ligand 0.46

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ ESR1 P03372 17/20 0.46
▸ UCHL1 P09936 1/20 0.38
▸ ESR2 Q92731 1/20 0.38
▸ HSD17B1 P14061 1/20 0.38

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
SCHEMBL21260838 0.93 ESR1 (0.50) ESR1ESR2
SCHEMBL21260892 0.91 ESR1 (0.47) ESR1ESR2HSD17B1
SCHEMBL21260884 0.90 ESR1 (0.46) ESR1ESR2HSD17B1
SCHEMBL21260777 0.89 ESR1 (0.49) ESR1HSD17B1
SCHEMBL21261040 0.89 ESR1 (0.44) ESR1UCHL1ESR2
SCHEMBL21260985 0.88 ESR1 (0.55) ESR1
SCHEMBL21260833 0.88 ESR1 (0.52) ESR1
SCHEMBL21261067 0.88 ESR1 (0.46) ESR1ESR2
SCHEMBL21260770 0.88 ESR1 (0.45) ESR1UCHL1ESR2HSD17B1
SCHEMBL21260836 0.88 ESR1 (0.48) ESR1ESR2HSD17B1

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 1/4885UCHL1 4143/4885ESR2 2/4885
US-10703747-B2 Benzothiophene-based selective mixed estrogen receptor downregulators ESR1, ESR2, GPER1 ESR1 1/4885UCHL1 4143/4885ESR2 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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