SCHEMBL16585519

SCHEMBL16585519

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)NCCSC(=O)CCC(=O)CCN

nearest known ligand 0.86

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ NAA50 Q9GZZ1 2/20 0.84
▸ CHAT P28329 2/20 0.81
▸ EP300 Q09472 3/20 0.79
▸ KAT5 Q92993 2/20 0.79
▸ AURKA O14965 2/20 0.79
▸ KAT2B Q92831 1/20 0.79
▸ CREBBP Q92793 1/20 0.71

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
SCHEMBL19857088 0.97 NAA50 (0.88) NAA50CHATEP300KAT5AURKA
SCHEMBL59721 0.97 NAA50 (0.88) NAA50CHATEP300KAT5AURKA
SCHEMBL18918373 0.96 NAA50 (0.85) NAA50CHATEP300KAT5AURKA
Ammonia Solution, Strong SCHEMBL60556 0.96 NAA50 (0.87) NAA50CHATEP300KAT5AURKA
SCHEMBL28077759 0.96 NAA50 (0.84) NAA50CHATEP300KAT5AURKA
SCHEMBL16585582 0.96 NAA50 (0.84) NAA50CHATEP300KAT5AURKA
SCHEMBL22556110 0.95 NAA50 (0.87) NAA50CHATEP300KAT5AURKA
SCHEMBL29530678 0.95 NAA50 (0.87) NAA50CHATEP300KAT5AURKA
SCHEMBL59962 0.95 NAA50 (0.87) NAA50CHATEP300KAT5AURKA
SCHEMBL16585400 0.95 NAA50 (0.84) NAA50CHATEP300KAT5AURKA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12104160-B2 Production of 4,6-dihydroxy-2-oxo-hexanoic acid ZYMOCHEM, INC. (US) 2024-10-01 — — US disclosed
US-20220389433-A1 HIGH YIELD ROUTE FOR THE PRODUCTION OF COMPOUNDS FROM RENEWABLE SOURCES ZYMOCHEM, INC. 2022-12-08 — — US disclosed
US-20200255840-A1 HIGH YIELD ROUTE FOR THE PRODUCTION OF 1, 6-HEXANEDIOL ZYMOCHEM INC (US) 2020-08-13 — — US disclosed
US-20170044551-A1 HIGH YIELD ROUTE FOR THE PRODUCTION OF COMPOUNDS FROM RENEWABLE SOURCES ZYMOCHEM INC. 2017-02-16 — — US disclosed
EP-3047030-A2 A HIGH YIELD ROUTE FOR THE PRODUCTION OF COMPOUNDS FROM RENEWABLE SOURCES Zymochem Inc. (US) 2016-07-27 — — EP disclosed
CN-105745327-A High-yield route for producing compounds from renewable resources 兹莫克姆有限公司 2016-07-06 — — CN disclosed
WO-2015042201-A2 A HIGH YIELD ROUTE FOR THE PRODUCTION OF COMPOUNDS FROM RENEWABLE SOURCES ZYMOCHEM INC. (US) 2015-03-26 — — WO disclosed
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