SCHEMBL18918373

SCHEMBL18918373

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)CCN

nearest known ligand 0.89

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ NAA50 Q9GZZ1 2/20 0.85
▸ CHAT P28329 2/20 0.82
▸ EP300 Q09472 3/20 0.80
▸ KAT5 Q92993 2/20 0.80
▸ AURKA O14965 2/20 0.80
▸ KAT2B Q92831 1/20 0.80
▸ CREBBP Q92793 1/20 0.72

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 0.97 NAA50 (0.84) NAA50CHATEP300KAT5AURKA
SCHEMBL29404284 0.97 NAA50 (0.84) NAA50CHATEP300KAT5AURKA
SCHEMBL28215952 0.97 NAA50 (0.84) NAA50CHATEP300KAT5AURKA
SCHEMBL18918371 0.97 NAA50 (0.84) NAA50CHATEP300KAT5AURKA
SCHEMBL16585519 0.96 NAA50 (0.84) NAA50CHATEP300KAT5AURKA
SCHEMBL19857088 0.96 NAA50 (0.88) NAA50CHATEP300KAT5AURKA
SCHEMBL59721 0.96 NAA50 (0.88) NAA50CHATEP300KAT5AURKA
SCHEMBL416543 0.96 NAA50 (0.85) NAA50CHATEP300KAT5AURKA
SCHEMBL380683 0.96 NAA50 (0.85) NAA50CHATEP300KAT5AURKA
SCHEMBL21874948 0.96 NAA50 (0.85) 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 13 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-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-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-2017096260-A1 METHODS AND MATERIALS FOR PRODUCING 7-CARBON MONOMERS INVISTA NORTH AMERICA S.A.R.L. (US) 2017-06-08 — — WO 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
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
Send feedback