SCHEMBL12660840

SCHEMBL12660840

CC(C)(COP(=O)(O)OP(=O)(O)OCC1OC(n2cnc3c(N)ncnc32)C(O)C1OP(=O)(O)O)C(O)C(=O)NCCC(=O)NCCSC(=O)CO

nearest known ligand 0.90

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ NAA50 Q9GZZ1 2/20 0.89
▸ CHAT P28329 2/20 0.85
▸ EP300 Q09472 3/20 0.84
▸ KAT5 Q92993 2/20 0.84
▸ AURKA O14965 2/20 0.84
▸ KAT2B Q92831 1/20 0.84
▸ CREBBP Q92793 1/20 0.74
▸ NAA40 Q86UY6 1/20 0.73

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
SCHEMBL29413819 1.00 NAA50 (0.89) NAA50CHATEP300KAT5AURKA
SCHEMBL11032851 1.00 NAA50 (0.89) NAA50CHATEP300KAT5AURKA
SCHEMBL20164068 1.00 NAA50 (0.89) NAA50CHATEP300KAT5AURKA
SCHEMBL12077703 0.96 NAA50 (0.86) NAA50CHATEP300KAT5AURKA
SCHEMBL60498 0.96 NAA50 (0.88) NAA50CHATEP300KAT5AURKA
SCHEMBL18327204 0.96 NAA50 (0.88) NAA50CHATEP300KAT5AURKA
SCHEMBL16983021 0.96 NAA50 (0.88) NAA50CHATEP300KAT5AURKA
SCHEMBL14878909 0.96 NAA50 (0.88) NAA50CHATEP300KAT5AURKA
SCHEMBL18925864 0.95 NAA50 (0.87) NAA50CHATEP300KAT5AURKA
SCHEMBL19554420 0.95 NAA50 (0.87) 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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20110118434-A1 METHOD FOR POLYMERISING GLYCOLIC ACID WITH MICROORGANISMS METABOLIC EXPLORER 2011-05-19 — — US disclosed
WO-2010004032-A1 METHOD FOR POLYMERISING GLYCOLIC ACID WITH MICROORGANISMS METABOLIC EXPLORER (FR) 2010-01-14 — — WO disclosed
Send feedback