SCHEMBL24976214

SCHEMBL24976214

C[C@H](NP(=O)(OCC1O[C@@](C#N)(c2ccc3c(N)ncnn23)[C@H](O)C1O)Oc1ccccc1)C(=O)OC1CCCCC1

nearest known ligand 0.78

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ TMPRSS2 O15393 1/20 0.39
▸ CYP3A4 P08684 2/20 0.35
▸ CYP2C9 P11712 2/20 0.35
▸ RIPK1 Q13546 2/20 0.31
▸ POLRMT O00411 1/20 0.31
▸ BTN3A1 O00481 2/20 0.31
▸ TRPM2 O94759 1/20 0.31

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
SCHEMBL17712316 1.00 TMPRSS2 (0.39) TMPRSS2CYP3A4CYP2C9RIPK1POLRMT
SCHEMBL17712512 1.00 TMPRSS2 (0.39) TMPRSS2CYP3A4CYP2C9RIPK1POLRMT
SCHEMBL18309986 1.00 TMPRSS2 (0.39) TMPRSS2CYP3A4CYP2C9RIPK1POLRMT
SCHEMBL18309987 0.99 TMPRSS2 (0.40) TMPRSS2CYP3A4CYP2C9RIPK1POLRMT
SCHEMBL17712519 0.99 TMPRSS2 (0.40) TMPRSS2CYP3A4CYP2C9RIPK1POLRMT
SCHEMBL17712257 0.99 TMPRSS2 (0.40) TMPRSS2CYP3A4CYP2C9RIPK1POLRMT
SCHEMBL17712262 0.98 TMPRSS2 (0.40) TMPRSS2CYP3A4CYP2C9RIPK1POLRMT
SCHEMBL24462486 0.98 TMPRSS2 (0.40) TMPRSS2CYP3A4CYP2C9RIPK1POLRMT
SCHEMBL17712260 0.98 TMPRSS2 (0.40) TMPRSS2CYP3A4CYP2C9RIPK1POLRMT
SCHEMBL24148739 0.94 TMPRSS2 (0.39) TMPRSS2CYP3A4CYP2C9RIPK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230027727-A1 METHODS FOR TREATING ARENAVIRIDAE AND CORONAVIRIDAE VIRUS INFECTIONS GILEAD SCIENCES, INC. 2023-01-26 — — 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-20230027727-A1 METHODS FOR TREATING ARENAVIRIDAE AND CORONAVIRIDAE VIRUS INFECTIONS PNP, ACE, ACE2 TMPRSS2 14/4885CYP3A4 1181/4885CYP2C9 2188/4885

“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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