SCHEMBL30411982

SCHEMBL30411982

CC[C@H](C)C(=O)SCCNC(=O)CCNC(=O)[C@H](O)C(C)(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

nearest known ligand 0.86

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
NAA50 Q9GZZ1 2/20 0.86
CHAT P28329 2/20 0.82
EP300 Q09472 3/20 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

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
SCHEMBL22612561 1.00 NAA50 (0.86) NAA50CHATEP300AURKAKAT5
SCHEMBL120171 1.00 NAA50 (0.86) NAA50CHATEP300AURKAKAT5
SCHEMBL26135395 1.00 NAA50 (0.86) NAA50CHATEP300AURKAKAT5
SCHEMBL1533824 1.00 NAA50 (0.86) NAA50CHATEP300AURKAKAT5
SCHEMBL22609304 1.00 NAA50 (0.86) NAA50CHATEP300AURKAKAT5
SCHEMBL29699328 1.00 NAA50 (0.86) NAA50CHATEP300AURKAKAT5
SCHEMBL2935253 1.00 NAA50 (0.86) NAA50CHATEP300AURKAKAT5
SCHEMBL22612510 1.00 NAA50 (0.86) NAA50CHATEP300AURKAKAT5
SCHEMBL28487648 0.98 NAA50 (0.84) NAA50CHATEP300AURKAKAT5
SCHEMBL30046331 0.96 NAA50 (0.84) NAA50CHATEP300AURKAKAT5

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4453228-A2 SAPONIN PRODUCTION IN YEAST The Regents of the University of California (US) 2024-10-30 EP claimed
US-20240352498-A1 Saponin production in yeast THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2024-10-24 US claimed
CN-118742650-A Production of saponins in yeast 加利福尼亚大学董事会 2024-10-01 CN claimed
WO-2023122801-A2 SAPONIN PRODUCTION IN YEAST THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2023-06-29 WO claimed
EP-4453228-A2 SAPONIN PRODUCTION IN YEAST The Regents of the University of California (US) 2024-10-30 EP disclosed
US-20240352498-A1 Saponin production in yeast THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2024-10-24 US disclosed
CN-118742650-A Production of saponins in yeast 加利福尼亚大学董事会 2024-10-01 CN disclosed
WO-2023122801-A2 SAPONIN PRODUCTION IN YEAST THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2023-06-29 WO disclosed
US-11634718-B2 Production of macrocyclic ketones in recombinant hosts TAKASAGO INTERNATIONAL CORPORATION (JP) 2023-04-25 US disclosed