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SCHEMBL18925866

SCHEMBL18925866

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)CC(=O)CCCO

nearest known ligand 0.88

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ NAA50 Q9GZZ1 2/20 0.84
▸ EP300 Q09472 3/20 0.81
▸ CHAT P28329 2/20 0.81
▸ AURKA O14965 2/20 0.81
▸ KAT5 Q92993 2/20 0.81
▸ KAT2B Q92831 1/20 0.81
▸ CREBBP Q92793 1/20 0.71
▸ NAA40 Q86UY6 1/20 0.70

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
SCHEMBL21314167 1.00 NAA50 (0.84) NAA50EP300CHATAURKAKAT5
SCHEMBL29806102 1.00 NAA50 (0.84) NAA50EP300CHATAURKAKAT5
SCHEMBL14918771 1.00 NAA50 (0.84) NAA50EP300CHATAURKAKAT5
SCHEMBL18838134 0.98 NAA50 (0.84) NAA50EP300CHATAURKAKAT5
SCHEMBL28813886 0.97 NAA50 (0.85) NAA50EP300CHATAURKAKAT5
SCHEMBL21874948 0.97 NAA50 (0.85) NAA50EP300CHATAURKAKAT5
SCHEMBL416543 0.97 NAA50 (0.85) NAA50EP300CHATAURKAKAT5
SCHEMBL15018707 0.97 NAA50 (0.85) NAA50EP300CHATAURKAKAT5
SCHEMBL12077703 0.97 NAA50 (0.86) NAA50EP300CHATAURKAKAT5
SCHEMBL18925864 0.96 NAA50 (0.87) NAA50EP300CHATAURKAKAT5

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20170159031-A1 POLYPEPTIDES FOR CARBON-CARBON BOND FORMATION AND USES THEREOF INVISTA North America S.à.r.l. 2017-06-08 — — US disclosed
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