SCHEMBL23278049

SCHEMBL23278049

N#CC1(c2ccc3c(N)ncnn23)O[C@@H]2C(OCc3ccccc3)C2[C@H]1OCc1ccccc1

nearest known ligand 0.44

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ TMPRSS2 O15393 1/20 0.33
▸ TNK2 Q07912 2/20 0.32
▸ EGLN2 Q96KS0 1/20 0.30
▸ RIPK1 Q13546 2/20 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
SCHEMBL20553048 0.85 PDE2A (0.35) TMPRSS2
SCHEMBL20477154 0.85 PDE2A (0.35) TMPRSS2
SCHEMBL12243178 0.85 PDE2A (0.35) TMPRSS2
SCHEMBL29727834 0.85 PDE2A (0.35) TMPRSS2
SCHEMBL17712276 0.85 PDE2A (0.35) TMPRSS2
SCHEMBL27086511 0.85 PDE2A (0.35) TMPRSS2
SCHEMBL20380375 0.85 TNK2 (0.36) TNK2RIPK1
SCHEMBL17719370 0.82 TMPRSS2 (0.35) TMPRSS2TNK2RIPK1
SCHEMBL10120684 0.82 TMPRSS2 (0.35) TMPRSS2TNK2RIPK1
SCHEMBL23278553 0.82 TNK2 (0.33) TMPRSS2TNK2

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-20210403497-A1 PROCESSES AND INTERMEDIATES FOR THE PREPARATION OF 1`-SUBSTITUTED CARBA-NUCLEOSIDE ANALOGS GILEAD SCIENCES, INC. 2021-12-30 — — US disclosed
US-10988498-B2 Processes and intermediates for the preparation of 1′-substituted carba-nucleoside analogs GILEAD SCIENCES, INC. (US) 2021-04-27 — — 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-20210403497-A1 PROCESSES AND INTERMEDIATES FOR THE PREPARATION OF 1`-SUBSTITUTED CARBA-NUCLEOSIDE ANALOGS PNP, TYMP, TYMS TMPRSS2 4701/4885TNK2 602/4885EGLN2 2620/4885
US-10988498-B2 Processes and intermediates for the preparation of 1′-substituted carba-nucleoside analogs PNP, TYMP, CDA TMPRSS2 4714/4885TNK2 594/4885EGLN2 2550/4885

“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