SCHEMBL14124932

SCHEMBL14124932

CC(C)(COP(=O)(O)OP(=O)(O)OCC1OC(n2cnc3c(N)ncnc32)C(O)C1OP(=O)(O)O)C(O)C(=O)NCCC(=O)NCCC(=O)CCC[N+](C)(C)C

nearest known ligand 0.85

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ EP300 Q09472 3/20 0.85
▸ CHAT P28329 2/20 0.85
▸ NAA50 Q9GZZ1 2/20 0.85
▸ AURKA O14965 2/20 0.85
▸ KAT5 Q92993 2/20 0.85
▸ KAT2B Q92831 1/20 0.85
▸ CREBBP Q92793 1/20 0.69

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
SCHEMBL9945415 0.94 EP300 (0.88) EP300CHATNAA50AURKAKAT5
SCHEMBL14124911 0.93 EP300 (0.85) EP300CHATNAA50AURKAKAT5
SCHEMBL16216007 0.93 EP300 (0.89) EP300CHATNAA50AURKAKAT5
SCHEMBL14124928 0.93 EP300 (0.86) EP300CHATNAA50AURKAKAT5
Coenzyme_A SCHEMBL29757150 0.93 EP300 (0.99) EP300CHATNAA50AURKAKAT5
SCHEMBL14124851 0.92 EP300 (0.86) EP300CHATNAA50AURKAKAT5
SCHEMBL14124919 0.92 EP300 (0.86) EP300CHATNAA50AURKAKAT5
Coenzyme_A SCHEMBL30630293 0.92 EP300 (0.98) EP300CHATNAA50AURKAKAT5
SCHEMBL16215999 0.92 EP300 (0.89) EP300CHATNAA50AURKAKAT5
Coenzyme_A SCHEMBL26752 0.92 EP300 (1.00) EP300CHATNAA50AURKAKAT5

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-20150252392-A1 BIOLOGICAL SYNTHESIS OF DIFUNCTIONAL HEXANES AND PENTANES FROM CARBOHYDRATE FEEDSTOCKS CODON DEVICES, INC. 2015-09-10 — — US disclosed
US-9102961-B2 Biological synthesis of difunctional hexanes and pentanes from carbohydrate feedstocks CELEXION, LLC (US) 2015-08-11 — — US disclosed
US-20140212934-A1 BIOLOGICAL SYNTHESIS OF DIFUNCTIONAL HEXANES AND PENTANES FROM CARBOHYDRATE FEEDSTOCKS CELEXION, LLC (US) 2014-07-31 — — US disclosed
US-8722385-B2 Biological synthesis of difunctional hexanes and pentanes from carbohydrate feedstocks CELEXION, LLC (US) 2014-05-13 — — US disclosed
US-8404465-B2 Biological synthesis of 6-aminocaproic acid from carbohydrate feedstocks CELEXION, LLC (US) 2013-03-26 — — US disclosed
US-20130017593-A1 Biological Synthesis of Difunctional Hexanes and Pentanes from Carbohydrate Feedstocks CELEXION, LLC (US) 2013-01-17 — — US disclosed
US-20120301950-A1 BIOLOGICAL SYNTHESIS OF DIFUNCTIONAL HEXANES AND PENTANES FROM CARBOHYDRATE FEEDSTOCKS CELEXION, LLC 2012-11-29 — — US disclosed
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