SCHEMBL25387491

SCHEMBL25387491

CCC(CC)C(=O)Nc1ncnn2c([C@@H]3O[C@](C#N)(COC(=O)C(CC)CC)[C@@H](O)[C@H]3O)ccc12

nearest known ligand 0.37

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ TMPRSS2 O15393 1/20 0.37
▸ POLRMT O00411 1/20 0.33
▸ ADORA2A P29274 1/20 0.31
▸ ADORA1 P30542 1/20 0.31
▸ CYP2C9 P11712 1/20 0.30
▸ FPR1 P21462 1/20 0.30

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
SCHEMBL25388197 0.87 TMPRSS2 (0.33) TMPRSS2
SCHEMBL26229812 0.87 POLRMT (0.35) TMPRSS2POLRMT
SCHEMBL25386674 0.87 POLRMT (0.45) TMPRSS2POLRMT
SCHEMBL25388404 0.86 TMPRSS2 (0.38) TMPRSS2POLRMT
SCHEMBL25385813 0.81 TMPRSS2 (0.42) TMPRSS2POLRMT
SCHEMBL25385912 0.80 TMPRSS2 (0.37) TMPRSS2POLRMT
SCHEMBL26287316 0.80 TMPRSS2 (0.35) TMPRSS2POLRMT
SCHEMBL30513671 0.79 POLRMT (0.44) TMPRSS2POLRMT
SCHEMBL26823086 0.79 TMPRSS2 (0.40) TMPRSS2POLRMT
SCHEMBL25393194 0.78 POLRMT (0.46) TMPRSS2POLRMT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4486455-A1 ANTIVIRAL COMPOUNDS AND METHODS OF MAKING AND USING THE SAME GILEAD SCIENCES, INC. (US) 2025-01-08 — — EP disclosed
US-20240199676-A1 ANTIVIRAL COMPOUNDS AND METHODS OF MAKING AND USING THE SAME GILEAD SCIENCES, INC. 2024-06-20 — — US disclosed
WO-2023168194-A1 ANTIVIRAL COMPOUNDS AND METHODS OF MAKING AND USING THE SAME GILEAD SCIENCES, INC. (US) 2023-09-07 — — 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 (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-20240199676-A1 ANTIVIRAL COMPOUNDS AND METHODS OF MAKING AND USING THE SAME EIF2AK2, MAVS, ZC3HAV1 TMPRSS2 553/4885POLRMT 13/4885ADORA2A 1182/4885

“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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