SCHEMBL29359401

SCHEMBL29359401

CC(C)(COP(=O)(O)OP(=O)(O)OC[C@H]1O[C@@H](n2cnc3c(N)ncnc32)[C@H](O)[C@@H]1OP(=O)(O)O)[C@@H](O)C(=O)NCCC(=O)NCCSCO

nearest known ligand 0.87

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ CHAT P28329 2/20 0.87
▸ NAA50 Q9GZZ1 2/20 0.87
▸ EP300 Q09472 4/20 0.86
▸ KAT5 Q92993 2/20 0.86
▸ AURKA O14965 2/20 0.86
▸ KAT2B Q92831 1/20 0.86
▸ NAA40 Q86UY6 1/20 0.79
▸ CREBBP Q92793 1/20 0.79

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
SCHEMBL19211093 1.00 CHAT (0.87) CHATNAA50EP300KAT5AURKA
SCHEMBL29423878 0.95 CHAT (0.87) CHATNAA50EP300KAT5AURKA
SCHEMBL18608119 0.95 CHAT (0.87) CHATNAA50EP300KAT5AURKA
SCHEMBL29613056 0.95 CHAT (0.84) CHATNAA50EP300KAT5AURKA
SCHEMBL22125027 0.95 CHAT (0.84) CHATNAA50EP300KAT5AURKA
SCHEMBL13735029 0.95 CHAT (0.84) CHATNAA50EP300KAT5AURKA
SCHEMBL18250353 0.95 CHAT (0.86) CHATNAA50EP300KAT5AURKA
SCHEMBL16154933 0.95 CHAT (0.86) CHATNAA50EP300KAT5AURKA
SCHEMBL22810879 0.95 CHAT (0.86) CHATNAA50EP300KAT5AURKA
SCHEMBL16856326 0.95 CHAT (0.86) CHATNAA50EP300KAT5AURKA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-120738232-A Bacterial strain fermentation method for synthesizing sclareol 武穴格莱默生物科技有限公司 2025-10-03 — — CN disclosed
CN-117778218-A Recombinant yarrowia lipolytica capable of producing abscisic acid in high yield as well as construction method and application thereof 南京工业大学 2024-03-29 — — CN disclosed
CN-116656512-A Sclareum endophytic fungus and screening separation and application thereof 广西科学院 2023-08-29 — — CN disclosed
CN-115916994-A Detection of methylcytosine and its derivatives using S-adenosyl-L-methionine analogue (xSAM) 伊鲁米那股份有限公司 2023-04-04 — — CN disclosed
US-20220290234-A1 DETECTING METHYLCYTOSINE AND ITS DERIVATIVES USING S-ADENOSYL-L-METHIONINE ANALOGS (xSAMS) ILLUMINA, INC. (US) 2022-09-15 — — US disclosed
US-20220023274-A1 USE OF A BERBERIS AND RESVERATROL MIXTURE TO CONTROL DYSLIPIDEMIA S&R FARMACEUTICI S.P.A. (IT) 2022-01-27 — — 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-20220290234-A1 DETECTING METHYLCYTOSINE AND ITS DERIVATIVES USING S-ADENOSYL-L-METHIONINE ANALOGS (xSAMS) MTAP, RNMT, RNGTT CHAT 935/4885NAA50 844/4885EP300 2764/4885

“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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