SCHEMBL29576733

SCHEMBL29576733

CC[C@H](C)[C@H](NC(=O)[C@@H](N)CC(C)C)C(=O)N[C@@H](CO)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CO)C(=O)O

nearest known ligand 0.51

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ NTSR2 O95665 15/20 0.51
▸ NTSR1 P30989 15/20 0.51
▸ SORT1 Q99523 13/20 0.51
▸ REN P00797 1/20 0.51
▸ CAPN1 P07384 2/20 0.51
▸ XIAP P98170 1/20 0.50

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
SCHEMBL32681284 0.89 CAPN1 (0.53) NTSR2NTSR1SORT1RENCAPN1
SCHEMBL3857550 0.87 CAPN1 (0.55) NTSR2NTSR1SORT1RENCAPN1
SCHEMBL3857546 0.87 CAPN1 (0.55) NTSR2NTSR1SORT1RENCAPN1
SCHEMBL3253690 0.85 CAPN1 (0.51) RENCAPN1
SCHEMBL3253682 0.85 CAPN1 (0.51) RENCAPN1
SCHEMBL31337510 0.85 TGM2 (0.51) NTSR2NTSR1SORT1RENXIAP
SCHEMBL29607537 0.84 CAPN1 (0.52) NTSR2NTSR1SORT1RENCAPN1
SCHEMBL29614726 0.84 NTSR2 (0.51) NTSR2NTSR1SORT1CAPN1XIAP
SCHEMBL29625336 0.84 XIAP (0.53) NTSR2NTSR1SORT1RENXIAP
SCHEMBL31257087 0.84 XIAP (0.59) NTSR2NTSR1SORT1RENXIAP

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-11312974-B2 Gene for increasing plant biomass and use therefor KANEKA CORPORATION (JP) 2022-04-26 — — US disclosed
Send feedback