SCHEMBL26331575

SCHEMBL26331575

CCC(=O)O[C@H]1[C@H](c2ccc3c(N)ncnn23)O[C@](C#N)(CO[P@@](=O)(N[C@@H](C)C(=O)OC(C)C)Oc2ccccc2)[C@H]1OC(=O)CC

nearest known ligand 0.51

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ BTN3A1 O00481 4/20 0.37
▸ CYP3A4 P08684 2/20 0.36
▸ CYP2C9 P11712 2/20 0.36
▸ POLRMT O00411 1/20 0.33
▸ DOT1L Q8TEK3 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
SCHEMBL23803273 1.00 BTN3A1 (0.37) BTN3A1CYP3A4CYP2C9POLRMTDOT1L
SCHEMBL23803274 1.00 BTN3A1 (0.37) BTN3A1CYP3A4CYP2C9POLRMTDOT1L
SCHEMBL23803440 1.00 BTN3A1 (0.37) BTN3A1CYP3A4CYP2C9POLRMTDOT1L
SCHEMBL26331170 0.97 BTN3A1 (0.37) BTN3A1CYP3A4CYP2C9POLRMT
SCHEMBL26296565 0.95 CYP3A4 (0.38) BTN3A1CYP3A4CYP2C9POLRMTDOT1L
SCHEMBL26276352 0.95 CYP3A4 (0.38) BTN3A1CYP3A4CYP2C9POLRMTDOT1L
SCHEMBL23803248 0.95 BTN3A1 (0.35) BTN3A1CYP3A4CYP2C9POLRMTDOT1L
SCHEMBL23803245 0.95 BTN3A1 (0.35) BTN3A1CYP3A4CYP2C9POLRMTDOT1L
SCHEMBL23803335 0.95 BTN3A1 (0.35) BTN3A1CYP3A4CYP2C9POLRMTDOT1L
SCHEMBL23819105 0.95 BTN3A1 (0.35) BTN3A1CYP3A4CYP2C9POLRMTDOT1L

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-11767337-B2 Antiviral compounds GILEAD SCIENCES, INC. (US) 2023-09-26 — — 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-11767337-B2 Antiviral compounds MAVS, HAVCR2, ZC3HAV1 BTN3A1 4597/4885CYP3A4 435/4885CYP2C9 1982/4885

“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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