SCHEMBL26287874

SCHEMBL26287874

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

nearest known ligand 0.44

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ POLRMT O00411 1/20 0.40
▸ DOT1L Q8TEK3 2/20 0.32
▸ TMPRSS2 O15393 1/20 0.31
▸ ALDH1A1 P00352 1/20 0.31
▸ KMT2A Q03164 1/20 0.31
▸ RIPK1 Q13546 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
SCHEMBL26281865 0.94 POLRMT (0.39) POLRMTDOT1LTMPRSS2RIPK1
SCHEMBL23818614 0.94 POLRMT (0.41) POLRMTDOT1LTMPRSS2RIPK1
SCHEMBL26287131 0.93 POLRMT (0.38) POLRMTDOT1L
SCHEMBL26287762 0.92 POLRMT (0.40) POLRMTDOT1LRIPK1
SCHEMBL26287825 0.90 POLRMT (0.38) POLRMTDOT1L
SCHEMBL23818477 0.87 POLRMT (0.41) POLRMTDOT1LTMPRSS2ALDH1A1KMT2A
SCHEMBL23844143 0.86 POLRMT (0.40) POLRMTDOT1LRIPK1
SCHEMBL23819282 0.85 POLRMT (0.44) POLRMTDOT1LTMPRSS2ALDH1A1KMT2A
SCHEMBL26287516 0.85 POLRMT (0.35) POLRMTDOT1L
SCHEMBL26287460 0.85 POLRMT (0.36) POLRMT

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-20230295201-A1 ANTIVIRAL COMPOUNDS GILEAD SCIENCES, INC. 2023-09-21 — — 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-20230295201-A1 ANTIVIRAL COMPOUNDS MAVS, HAVCR2, ZC3HAV1 POLRMT 535/4885DOT1L 3143/4885TMPRSS2 324/4885

“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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