SCHEMBL20022254

SCHEMBL20022254

COc1cc2sc(C(=O)CCC(=O)O)cc2c(F)c1OC

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
▸ STING1 Q86WV6 20/20 1.00

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
SCHEMBL31435090 1.00 STING1 (1.00) STING1
SCHEMBL21406275 0.92 STING1 (0.84) STING1
SCHEMBL21406231 0.91 STING1 (0.83) STING1
SCHEMBL20022180 0.90 STING1 (0.82) STING1
SCHEMBL20049611 0.90 STING1 (0.81) STING1
SCHEMBL21423039 0.90 STING1 (0.81) STING1
SCHEMBL31435098 0.89 STING1 (0.80) STING1
SCHEMBL21452691 0.89 STING1 (0.80) STING1
SCHEMBL23461402 0.89 STING1 (0.79) STING1
SCHEMBL23461389 0.89 STING1 (0.79) STING1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2023239675-A1 STING AGONIST COMPOUNDS SUTRO BIOPHARMA, INC. (US) 2023-12-14 — — WO disclosed
US-11312772-B2 Combinations of PD-1 antagonists and benzo [b] thiophene STING agonists for cancer treatment MERCK SHARP & DOHME CORP. (US) 2022-04-26 — — US disclosed
US-11285131-B2 Benzo[b]thiophene STING agonists for cancer treatment MERCK SHARP & DOHME CORP. (US) 2022-03-29 — — US disclosed
CN-110036001-B Benzo [ b ] thiophene compounds as STING agonists 默沙东公司 2022-03-22 — — CN disclosed
WO-2022002077-A1 ARYL AROMATIC HETEROCYCLIC DERIVATIVE AND PREPARATION METHOD THEREFOR AND USE THEREOF 上海海和药物研究开发股份有限公司 2022-01-06 — — WO disclosed
WO-2021113679-A1 DIMERIC COMPOUNDS AS STING AGONISTS MERSANA THERAPEUTICS, INC. (US) 2021-06-10 — — WO disclosed
US-20210130466-A1 Combinations of PD-1 Antagonists and Benzo[b]thiophene STING Agonists for Cancer Treatment MERCK SHARP & DOHME CORP. (US) 2021-05-06 — — US disclosed
US-20200330427-A1 Benzo[b]thiophene STING Agonists for Cancer Treatment MERCK SHARP & DOHME CORP. (US) 2020-10-22 — — US disclosed
US-10730849-B2 Benzo[b]thiophene compounds as STING agonists MERCK SHARP & DOHME CORP. (US) 2020-08-04 — — US disclosed
US-10703738-B2 Benzo[b]thiophene compounds as STING agonists MERCK SHARP & DOHME CORP. (US) 2020-07-07 — — US disclosed
US-20190337917-A1 BENZO[b]THIOPHENE COMPOUNDS AS STING AGONISTS MERCK SHARP & DOHME CORP. (US) 2019-11-07 — — US disclosed
US-10414747-B2 Benzo[b]thiophene compounds as sting agonists MERCK SHARP & DOHME CORP. (US) 2019-09-17 — — US disclosed
US-10414747-B2 Benzo[b]thiophene compounds as sting agonists MERCK SHARP & DOHME CORP. (US) 2019-09-17 — — US disclosed
WO-2019027857-A1 COMBINATIONS OF PD-1 ANTAGONISTS AND BENZO[b]THIOPHENE STING AGONISTS FOR CANCER TREATMENT MERCK SHARP & DOHME CORP. (US) 2019-02-07 — — WO disclosed
US-20180093964-A1 BENZO[b]THIOPHENE COMPOUNDS AS STING AGONISTS MERCK SHARP & DOHME CORP. (US) 2018-04-05 — — US disclosed
US-20180093964-A1 BENZO[b]THIOPHENE COMPOUNDS AS STING AGONISTS MERCK SHARP & DOHME CORP. (US) 2018-04-05 — — 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 (9 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-20210130466-A1 Combinations of PD-1 Antagonists and Benzo[b]thiophene STING Agonists for Cancer Treatment STING1, MAVS, IRF3 STING1 1/4885
US-10730849-B2 Benzo[b]thiophene compounds as STING agonists STING1, IRF3, CGAS STING1 1/4885
US-20180093964-A1 BENZO[b]THIOPHENE COMPOUNDS AS STING AGONISTS STING1, IRF3, CGAS STING1 1/4885
US-10414747-B2 Benzo[b]thiophene compounds as sting agonists STING1, IRF3, CGAS STING1 1/4885
US-11285131-B2 Benzo[b]thiophene STING agonists for cancer treatment STING1, IRF3, MAVS STING1 1/4885
US-11312772-B2 Combinations of PD-1 antagonists and benzo [b] thiophene STING agonists for cancer treatment STING1, MAVS, IRF3 STING1 1/4885
US-20190337917-A1 BENZO[b]THIOPHENE COMPOUNDS AS STING AGONISTS STING1, IRF3, CGAS STING1 1/4885
US-10703738-B2 Benzo[b]thiophene compounds as STING agonists STING1, IRF3, CGAS STING1 1/4885
US-20200330427-A1 Benzo[b]thiophene STING Agonists for Cancer Treatment STING1, IRF3, MAVS STING1 1/4885

“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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