SCHEMBL25976528

SCHEMBL25976528

CC(C)C(=O)CCC(NC(=O)CC[C@H](NC(=O)CCC(NC(=O)CCCCCCCCCCCCCCCCC(=O)O)C(=O)O)C(=O)O)C(=O)O

nearest known ligand 0.61

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ NOD1 Q9Y239 8/20 0.61
▸ GNPAT O15228 1/20 0.48
▸ FOLH1 Q04609 5/20 0.46
▸ NAALAD2 Q9Y3Q0 2/20 0.46
▸ RIMKLA Q8IXN7 1/20 0.46
▸ PLA2G10 O15496 2/20 0.46
▸ SLC6A5 Q9Y345 1/20 0.44

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
SCHEMBL21937170 1.00 NOD1 (0.61) NOD1GNPATFOLH1NAALAD2RIMKLA
SCHEMBL21937168 1.00 NOD1 (0.61) NOD1GNPATFOLH1NAALAD2RIMKLA
SCHEMBL25977900 1.00 NOD1 (0.61) NOD1GNPATFOLH1NAALAD2RIMKLA
SCHEMBL25976546 1.00 NOD1 (0.61) NOD1GNPATFOLH1NAALAD2RIMKLA
SCHEMBL25850237 1.00 NOD1 (0.61) NOD1GNPATFOLH1NAALAD2RIMKLA
SCHEMBL21937167 1.00 NOD1 (0.61) NOD1GNPATFOLH1NAALAD2RIMKLA
SCHEMBL21937004 1.00 NOD1 (0.61) NOD1GNPATFOLH1NAALAD2RIMKLA
SCHEMBL16715886 0.98 NOD1 (0.59) NOD1GNPATFOLH1NAALAD2RIMKLA
SCHEMBL16715888 0.98 NOD1 (0.59) NOD1GNPATFOLH1NAALAD2RIMKLA
SCHEMBL16661378 0.98 NOD1 (0.59) NOD1GNPATFOLH1NAALAD2RIMKLA

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
EP-3788063-B1 GIP DERIVATIVES AND USES THEREOF NOVO NORDISK AS (DK) 2023-08-09 — — EP disclosed
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