SCHEMBL7107598

SCHEMBL7107598

O=C(c1ccccc1)c1c(-c2ccc(O)cc2)sc2cc(O)ccc12

nearest known ligand 0.86

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
ESR1 P03372 19/20 0.75
ESR2 Q92731 16/20 0.68
MEN1 O00255 1/20 0.58
KMT2A Q03164 1/20 0.58
TDP1 Q9NUW8 1/20 0.58

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
SCHEMBL11547729 0.95 ESR1 (0.68) ESR1ESR2MEN1KMT2ATDP1
SCHEMBL11552368 0.94 ESR1 (0.75) ESR1ESR2MEN1KMT2ATDP1
SCHEMBL1665657 0.92 ESR1 (0.86) ESR1ESR2MEN1KMT2ATDP1
SCHEMBL11547449 0.90 CNR1 (0.64) ESR1ESR2MEN1KMT2ATDP1
SCHEMBL11550840 0.88 CNR1 (0.71) ESR1ESR2MEN1KMT2ATDP1
SCHEMBL8631942 0.86 ESR1 (0.81) ESR1ESR2MEN1KMT2ATDP1
SCHEMBL8562371 0.86 ESR1 (0.76) ESR1ESR2MEN1KMT2ATDP1
SCHEMBL8626952 0.86 ESR1 (0.80) ESR1ESR2MEN1KMT2ATDP1
SCHEMBL31683627 0.86 ESR1 (0.81) ESR1ESR2MEN1KMT2ATDP1
SCHEMBL7104864 0.86 ESR1 (1.00) ESR1ESR2MEN1KMT2ATDP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0819686-B1 Benzothiophene compounds, and uses and formulations thereof LILLY CO ELI (US) 2003-10-01 EP claimed
US-5972888-A LOWERING THE PRODUCTION OR RELEASE OF NEUROPEPTIDE Y WHICH COMPRISES ADMINISTERING TO A MAMMAL IN NEED THEREOF AN EFFECTIVE AMOUNT OF AN ISOLATED NATURALLY OCCURRING OBESITY PROTEIN, OR A PHARMACEUTICALLY ACCEPTABLE SALT THEREOF ELI LILLY AND COMPANY (US) 1999-10-26 US claimed
US-5780648-A Benzothiophene compounds, and uses formulations thereof ELI LILLY AND COMPANY (US) 1998-07-14 US claimed
EP-0819686-A1 Benzothiophene compounds, and uses and formulations thereof ELI LILLY AND COMPANY (US) 1998-01-21 EP claimed
US-20070099876-A1 Target directed chemotherapy of tumours of the sexual organs TRIN GMBH (CH) 2007-05-03 US disclosed
US-20070099876-A1 Target directed chemotherapy of tumours of the sexual organs TRIN GMBH (CH) 2007-05-03 US disclosed
EP-0819686-B1 Benzothiophene compounds, and uses and formulations thereof LILLY CO ELI (US) 2003-10-01 EP disclosed
US-5827876-A MODIFYING BALANCE BETWEEN BONE RESORPTION AND PRODUCTION AMERICAN HOME PRODUCTS CORPORATION (US) 1998-10-27 US disclosed
US-5780648-A Benzothiophene compounds, and uses formulations thereof ELI LILLY AND COMPANY (US) 1998-07-14 US disclosed
EP-0819686-A1 Benzothiophene compounds, and uses and formulations thereof ELI LILLY AND COMPANY (US) 1998-01-21 EP disclosed
US-4133814-A ANTITUMOR AGENTS ELI LILLY AND COMPANY (US) 1979-01-09 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-20070099876-A1 Target directed chemotherapy of tumours of the sexual organs GPER1, SHBG, GNRHR ESR1 4/4885ESR2 5/4885MEN1 629/4885

“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.