SCHEMBL23818994

SCHEMBL23818994

CO[C@@](C#N)(CCc1ccc2c(N)ncnn12)COP(=O)(N[C@@H](C)C(=O)OCC1CCN(CC(F)(F)F)CC1)Oc1ccccc1

nearest known ligand 0.45

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ BTN3A1 O00481 1/20 0.30
▸ HPGDS O60760 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
SCHEMBL23818629 0.91 BTN3A1 (0.31) BTN3A1
SCHEMBL26289572 0.91 BTN3A1 (0.33) BTN3A1HPGDS
SCHEMBL26293173 0.85 BTN3A1 (0.32) BTN3A1
SCHEMBL23818980 0.85 BTN3A1 (0.33) BTN3A1
SCHEMBL26332341 0.84 BTN3A1 (0.31) BTN3A1
SCHEMBL23818983 0.83 BTN3A1 (0.33) BTN3A1
SCHEMBL26332648 0.83 — —
SCHEMBL23819118 0.83 KDM4E (0.33) BTN3A1
SCHEMBL23818842 0.81 POLRMT (0.31) BTN3A1HPGDS
SCHEMBL26341746 0.80 BTN3A1 (0.36) BTN3A1

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-11767337-B2 Antiviral compounds GILEAD SCIENCES, INC. (US) 2023-09-26 — — US disclosed
US-20210284670-A1 ANTIVIRAL COMPOUNDS GILEAD SCIENCES, INC. 2021-09-16 — — 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-20210284670-A1 ANTIVIRAL COMPOUNDS MAVS, HAVCR2, ZC3HAV1 BTN3A1 4597/4885HPGDS 814/4885
US-11767337-B2 Antiviral compounds MAVS, HAVCR2, ZC3HAV1 BTN3A1 4597/4885HPGDS 814/4885

“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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