SCHEMBL31659019

SCHEMBL31659019

CCOC(=O)[C@H](C)NP(=O)(OC[C@H]1O[C@@](C#N)(c2ccc3c(N)ncnn23)[C@](C)(F)[C@@H]1O)Oc1cccc2ccccc12

nearest known ligand 0.57

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ CYP3A4 P08684 2/20 0.33
▸ CYP2C9 P11712 2/20 0.33

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
SCHEMBL10149559 1.00 CYP3A4 (0.33) CYP3A4CYP2C9
SCHEMBL27351037 1.00 CYP3A4 (0.33) CYP3A4CYP2C9
SCHEMBL10142621 0.94 BTN3A1 (0.31) CYP3A4CYP2C9
SCHEMBL15340439 0.94 BTN3A1 (0.31) CYP3A4CYP2C9
SCHEMBL10148624 0.94 CYP3A4 (0.33) CYP3A4CYP2C9
SCHEMBL10149548 0.90 CYP3A4 (0.41) CYP3A4CYP2C9
SCHEMBL27350904 0.90 CYP3A4 (0.41) CYP3A4CYP2C9
SCHEMBL15580662 0.89 — —
SCHEMBL15580650 0.89 — —
SCHEMBL15580664 0.89 — —

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-20250228814-A1 COMBINATION THERAPIES FOR THE TREATMENT OF VIRAL INFECTIONS FLAGSHIP PIONEERING INNOVATIONS VI, LLC 2025-07-17 — — 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-20250228814-A1 COMBINATION THERAPIES FOR THE TREATMENT OF VIRAL INFECTIONS HAVCR2, EIF2AK2, MAVS CYP3A4 4170/4885CYP2C9 4853/4885

“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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