SCHEMBL21356552

SCHEMBL21356552

COc1ccc(C(O[C@H]2C[C@@H](n3cnc4c(NC(=O)c5ccccc5)ncnc43)[C@H](O)[C@@H]2O[Si](C)(C)C(C)(C)C)(c2ccccc2)c2ccc(OC)cc2)cc1

nearest known ligand 0.47

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ ADORA2A P29274 2/20 0.40
▸ ADORA2B P29275 2/20 0.40
▸ TYMP P19971 1/20 0.37
▸ ADORA1 P30542 1/20 0.36
▸ PRMT6 Q96LA8 1/20 0.36

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
SCHEMBL21356334 0.89 ADORA2A (0.43) ADORA2AADORA2BTYMPADORA1
SCHEMBL20337206 0.89 TYMP (0.43) ADORA2AADORA2BTYMPADORA1
SCHEMBL20353027 0.89 TYMP (0.43) ADORA2AADORA2BTYMPADORA1
SCHEMBL20348400 0.86 TYMP (0.41) ADORA2AADORA2BTYMPADORA1
SCHEMBL21356527 0.86 ADORA2A (0.40) ADORA2AADORA2BTYMPADORA1PRMT6
SCHEMBL20353032 0.86 TYMP (0.43) ADORA2AADORA2BTYMPADORA1
SCHEMBL20337209 0.86 TYMP (0.43) ADORA2AADORA2BTYMPADORA1
SCHEMBL20348406 0.83 TYMP (0.41) ADORA2AADORA2BTYMP
SCHEMBL21356506 0.83 TYMP (0.47) TYMP
SCHEMBL20482910 0.82 TYMP (0.55) ADORA2AADORA2BTYMPADORA1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230382932-A1 Cyclopentane-Based Modulators of STING (Stimulator of Interferon Genes) PFIZER INC. (US) 2023-11-30 — — US disclosed
EP-3765474-B1 CYCLOPENTANE-BASED MODULATORS OF STING (STIMULATOR OF INTERFERON GENES) PFIZER (US) 2022-06-15 — — EP disclosed
US-20210230196-A1 Cyclopentane-Based Modulators of STING (Stimulator of Interferon Genes) PFIZER INC. (US) 2021-07-29 — — US disclosed
US-10968242-B2 Cyclopentane-based modulators of STING (stimulator of interferon genes) PFIZER INC. (US) 2021-04-06 — — US disclosed
EP-3765474-A1 CYCLOPENTANE-BASED MODULATORS OF STING (STIMULATOR OF INTERFERON GENES) Pfizer Inc (US) 2021-01-20 — — EP disclosed
US-20200102334-A1 Cyclopentane-Based Modulators of STING (Stimulator of Interferon Genes) PFIZER INC. (US) 2020-04-02 — — US disclosed
US-20190284216-A1 Cyclopentane-Based Modulators of STING (Stimulator of Interferon Genes) PFIZER INC. (US) 2019-09-19 — — US disclosed
WO-2019175776-A1 CYCLOPENTANE-BASED MODULATORS OF STING (STIMULATOR OF INTERFERON GENES) PFIZER INC. (US) 2019-09-19 — — WO 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-20210230196-A1 Cyclopentane-Based Modulators of STING (Stimulator of Interferon Genes) STING1, IRF3, CGAS ADORA2A 1183/4885ADORA2B 1539/4885TYMP 1265/4885
US-20190284216-A1 Cyclopentane-Based Modulators of STING (Stimulator of Interferon Genes) STING1, IRF3, CGAS ADORA2A 1183/4885ADORA2B 1539/4885TYMP 1265/4885
US-20230382932-A1 Cyclopentane-Based Modulators of STING (Stimulator of Interferon Genes) STING1, IRF3, CGAS ADORA2A 1183/4885ADORA2B 1539/4885TYMP 1265/4885
US-20200102334-A1 Cyclopentane-Based Modulators of STING (Stimulator of Interferon Genes) STING1, IRF3, CGAS ADORA2A 1183/4885ADORA2B 1539/4885TYMP 1265/4885
US-10968242-B2 Cyclopentane-based modulators of STING (stimulator of interferon genes) STING1, IRF3, CGAS ADORA2A 1183/4885ADORA2B 1539/4885TYMP 1265/4885

“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.

Send feedback