SCHEMBL20022337

SCHEMBL20022337

CCOC(=O)CCC(=O)c1cc2cc(OC)c(OC)cc2s1

nearest known ligand 0.81

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
STING1 Q86WV6 15/20 0.81
ACHE P22303 5/20 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
SCHEMBL30820009 1.00 STING1 (0.81) STING1ACHE
SCHEMBL31081229 0.92 STING1 (0.70) STING1ACHE
SCHEMBL31081226 0.92 STING1 (0.70) STING1ACHE
SCHEMBL24450978 0.91 STING1 (0.76) STING1ACHE
SCHEMBL29975965 0.91 STING1 (0.76) STING1ACHE
SCHEMBL20022332 0.91 STING1 (0.76) STING1ACHE
SCHEMBL20022335 0.91 STING1 (0.78) STING1ACHE
SCHEMBL20022249 0.90 STING1 (0.74) STING1ACHE
SCHEMBL20022237 0.90 STING1 (0.76) STING1ACHE
SCHEMBL20022266 0.90 STING1 (1.00) STING1ACHE

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
CN-118108716-A Benzothiophene compound and preparation method and application thereof 四川科伦博泰生物医药股份有限公司 2024-05-31 CN disclosed
CN-113518776-B Benzothiophene compound and preparation method and application thereof 四川科伦博泰生物医药股份有限公司 2024-03-26 CN disclosed
WO-2023077129-A1 TETRAZINE CONJUGATES FOR IN VIVO TARGETED DELIVERY OF A PAYLOAD TAMBO, INC. (US) 2023-05-04 WO disclosed
CN-114053431-A Liposome composition of compound with STING agonistic activity, and preparation method and application thereof 四川科伦药物研究院有限公司 2022-02-18 CN disclosed
CN-113518776-A Benzothiophenes, process for their preparation and their use 四川科伦博泰生物医药股份有限公司 2021-10-19 CN 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-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 (5 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-10730849-B2 Benzo[b]thiophene compounds as STING agonists STING1, IRF3, CGAS STING1 1/4885ACHE 2167/4885
US-20180093964-A1 BENZO[b]THIOPHENE COMPOUNDS AS STING AGONISTS STING1, IRF3, CGAS STING1 1/4885ACHE 2167/4885
US-10414747-B2 Benzo[b]thiophene compounds as sting agonists STING1, IRF3, CGAS STING1 1/4885ACHE 2167/4885
US-20190337917-A1 BENZO[b]THIOPHENE COMPOUNDS AS STING AGONISTS STING1, IRF3, CGAS STING1 1/4885ACHE 2167/4885
US-10703738-B2 Benzo[b]thiophene compounds as STING agonists STING1, IRF3, CGAS STING1 1/4885ACHE 2167/4885

“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.