SCHEMBL18918371

SCHEMBL18918371

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)CC(=O)CCCCN

nearest known ligand 0.87

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ NAA50 Q9GZZ1 2/20 0.84
▸ EP300 Q09472 3/20 0.80
▸ CHAT P28329 2/20 0.80
▸ AURKA O14965 2/20 0.80
▸ KAT5 Q92993 2/20 0.80
▸ KAT2B Q92831 1/20 0.80
▸ CREBBP Q92793 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
SCHEMBL285390 0.98 NAA50 (0.84) NAA50EP300CHATAURKAKAT5
SCHEMBL28215952 0.98 NAA50 (0.84) NAA50EP300CHATAURKAKAT5
SCHEMBL29404284 0.98 NAA50 (0.84) NAA50EP300CHATAURKAKAT5
SCHEMBL18918373 0.97 NAA50 (0.85) NAA50EP300CHATAURKAKAT5
SCHEMBL19693052 0.96 NAA50 (0.86) NAA50EP300CHATAURKAKAT5
SCHEMBL15299842 0.96 NAA50 (0.86) NAA50EP300CHATAURKAKAT5
SCHEMBL1333244 0.96 NAA50 (0.84) NAA50EP300CHATAURKAKAT5
SCHEMBL30558687 0.96 NAA50 (0.84) NAA50EP300CHATAURKAKAT5
SCHEMBL18838134 0.96 NAA50 (0.84) NAA50EP300CHATAURKAKAT5
SCHEMBL18918369 0.96 NAA50 (0.85) 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 8 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10988783-B2 Methods and materials for producing 7-carbon monomers INV NYLON CHEMICALS AMERICAS, LLC (US) 2021-04-27 — — US claimed
US-20200248210-A1 METHODS AND MATERIALS FOR PRODUCING 7-CARBON MONOMERS INVISTA North America S.á. r.l. 2020-08-06 — — US claimed
WO-2017096310-A1 METHODS AND MATERIALS FOR PRODUCING 7-CARBON MONOMERS INVISTA NORTH AMERICA S.A.R.L. (US) 2017-06-08 — — WO claimed
US-20170159082-A1 METHODS AND MATERIALS FOR PRODUCING 7-CARBON MONOMERS INVISTA NORTH AMERICA S.A.R.L. (US) 2017-06-08 — — US claimed
US-10988783-B2 Methods and materials for producing 7-carbon monomers INV NYLON CHEMICALS AMERICAS, LLC (US) 2021-04-27 — — US disclosed
US-20200248210-A1 METHODS AND MATERIALS FOR PRODUCING 7-CARBON MONOMERS INVISTA North America S.á. r.l. 2020-08-06 — — US disclosed
US-20170159082-A1 METHODS AND MATERIALS FOR PRODUCING 7-CARBON MONOMERS INVISTA NORTH AMERICA S.A.R.L. (US) 2017-06-08 — — US disclosed
WO-2017096310-A1 METHODS AND MATERIALS FOR PRODUCING 7-CARBON MONOMERS INVISTA NORTH AMERICA S.A.R.L. (US) 2017-06-08 — — WO disclosed
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