SCHEMBL26281133

SCHEMBL26281133

CCC(CC)COC(=O)[C@H](C)NCOC[C@@]1(C#N)O[C@@H](c2ccc3c(N)ncnn23)[C@H](O)[C@@H]1O

nearest known ligand 0.51

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ POLRMT O00411 1/20 0.39
▸ DOT1L Q8TEK3 2/20 0.31
▸ MEN1 O00255 1/20 0.30
▸ ALDH1A1 P00352 1/20 0.30
▸ LMNA P02545 1/20 0.30
▸ MAPT P10636 1/20 0.30
▸ KMT2A Q03164 1/20 0.30
▸ NPSR1 Q6W5P4 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
SCHEMBL26283409 1.00 POLRMT (0.39) POLRMTDOT1LMEN1ALDH1A1LMNA
SCHEMBL26283642 0.93 POLRMT (0.39) POLRMTDOT1LMEN1ALDH1A1LMNA
SCHEMBL23818477 0.93 POLRMT (0.41) POLRMTDOT1LALDH1A1KMT2A
SCHEMBL26285034 0.92 POLRMT (0.38) POLRMTDOT1L
SCHEMBL26287140 0.91 POLRMT (0.42) POLRMTDOT1L
SCHEMBL23818938 0.90 POLRMT (0.41) POLRMTDOT1L
SCHEMBL26283806 0.89 POLRMT (0.41) POLRMTDOT1L
SCHEMBL26287724 0.89 POLRMT (0.40) POLRMTDOT1L
SCHEMBL26280537 0.88 POLRMT (0.39) POLRMTDOT1L
SCHEMBL23819067 0.88 POLRMT (0.32) 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 3143/4885MEN1 3636/4885

“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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