SCHEMBL24119259

SCHEMBL24119259

CCOC(=O)[C@H](C)NP(=O)(N[C@@H](C)C(=O)OCC)OC[C@H]1O[C@@](C#N)(c2ccc3c(N)ncnn23)[C@H](C=O)[C@@H]1O

nearest known ligand 0.63

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ TMPRSS2 O15393 1/20 0.39
▸ POLRMT O00411 1/20 0.31
▸ RIPK1 Q13546 4/20 0.31
▸ CSNK2A2 P19784 1/20 0.30
▸ CSNK2A1 P68400 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
SCHEMBL10120830 0.93 TMPRSS2 (0.46) TMPRSS2POLRMTRIPK1CSNK2A2CSNK2A1
SCHEMBL18310024 0.91 TMPRSS2 (0.46) TMPRSS2POLRMTRIPK1
SCHEMBL22096270 0.86 TMPRSS2 (0.44) TMPRSS2POLRMTRIPK1
SCHEMBL10154198 0.86 TMPRSS2 (0.36) TMPRSS2POLRMTRIPK1CSNK2A2CSNK2A1
SCHEMBL20762105 0.85 TMPRSS2 (0.44) TMPRSS2POLRMTRIPK1
SCHEMBL20762571 0.85 POLRMT (0.34) TMPRSS2POLRMTRIPK1CSNK2A2CSNK2A1
SCHEMBL18666928 0.85 POLRMT (0.34) TMPRSS2POLRMTRIPK1CSNK2A2CSNK2A1
SCHEMBL10154374 0.84 TMPRSS2 (0.33) TMPRSS2POLRMTRIPK1CSNK2A2CSNK2A1
SCHEMBL14845681 0.83 TMPRSS2 (0.34) TMPRSS2POLRMTRIPK1CSNK2A2CSNK2A1
SCHEMBL10142407 0.83 TMPRSS2 (0.34) 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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11382926-B2 Methods for treating Arenaviridae and Coronaviridae virus infections GILEAD SCIENCES, INC. (US) 2022-07-12 — — US disclosed
US-20210393659-A1 METHODS FOR TREATING ARENAVIRIDAE AND CORONAVIRIDAE VIRUS INFECTIONS GILEAD SCIENCES, INC. 2021-12-23 — — 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 (2 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-11382926-B2 Methods for treating Arenaviridae and Coronaviridae virus infections ACE, PNP, ACE2 TMPRSS2 12/4885POLRMT 1645/4885RIPK1 902/4885
US-20210393659-A1 METHODS FOR TREATING ARENAVIRIDAE AND CORONAVIRIDAE VIRUS INFECTIONS ACE, PNP, ACE2 TMPRSS2 12/4885POLRMT 1645/4885RIPK1 902/4885

“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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