SCHEMBL5888717

SCHEMBL5888717

Cc1cn([C@@H]2O[C@H](C([O])C(=O)c3ccccc3)[C@@H](O)[C@H]2O)c(=O)nc1N

nearest known ligand 0.46

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 1/20 0.38
▸ HTT P42858 1/20 0.38
▸ NT5E P21589 2/20 0.37
▸ PRMT5 O14744 3/20 0.36
▸ WDR77 Q9BQA1 2/20 0.36
▸ P2RY6 Q15077 3/20 0.35
▸ LMNA P02545 1/20 0.34
▸ THRB P10828 1/20 0.34
▸ MTOR P42345 1/20 0.34
▸ MDM2 Q00987 1/20 0.34
▸ NCOA1 Q15788 1/20 0.34
▸ NCOA3 Q9Y6Q9 1/20 0.34
▸ ST6GAL1 P15907 1/20 0.34
▸ ADK P55263 2/20 0.33
▸ TAAR1 Q96RJ0 1/20 0.33
▸ P2RY14 Q15391 1/20 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
SCHEMBL5038377 0.77 ALDH1A1 (0.62) ALDH1A1HTTNT5EP2RY6LMNA
SCHEMBL29455714 0.76 AHCY (0.49) ALDH1A1HTTLMNATHRBMTOR
SCHEMBL23098378 0.74 ADK (0.56) LMNATHRBMTORMDM2NCOA1
SCHEMBL11790069 0.73 ALDH1A1 (0.47) ALDH1A1HTTP2RY6LMNATHRB
SCHEMBL15111406 0.73 ADK (0.39) ALDH1A1HTTLMNATHRBMTOR
SCHEMBL15855041 0.73 NT5E (0.40) NT5EP2RY6ADK
SCHEMBL5888586 0.73 AHCY (0.61) PRMT5WDR77
SCHEMBL21275623 0.72 LMNA (0.50) ALDH1A1HTTLMNATHRBMTOR
SCHEMBL16629487 0.72 LMNA (0.50) ALDH1A1HTTLMNATHRBMTOR
Diphenylether SCHEMBL3231397 0.71 ADORA2A (0.55) ALDH1A1HTTP2RY6LMNATHRB

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7030230-B2 Process of purifying phosphoramidites ISIS PHARMACEUTICALS, INC. (US) 2006-04-18 — — US claimed
WO-2004039469-A2 PROCESS OF PURIFYING PHOSPHORAMIDITES ISIS PHARMACEUTICALS, INC. (US) 2004-05-13 — — WO claimed
US-20040082775-A1 Process of purifying phosphoramidites ISIS PHARMACEUTICALS INC. 2004-04-29 — — US claimed

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-20040082775-A1 Process of purifying phosphoramidites PHOSPHO1, ADAR, POLRMT ALDH1A1 4728/4885HTT 1325/4885NT5E 1034/4885

“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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