SCHEMBL20375263

SCHEMBL20375263

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

nearest known ligand 0.47

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ NOD1 Q9Y239 5/20 0.47
▸ GLP1R P43220 8/20 0.43
▸ NMT2 O60551 1/20 0.43
▸ NMT1 P30419 1/20 0.43
▸ GLO1 Q04760 2/20 0.41
▸ PTGS1 P23219 1/20 0.38
▸ GSTK1 Q9Y2Q3 1/20 0.38
▸ FOLH1 Q04609 1/20 0.38

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
SCHEMBL21418066 1.00 NOD1 (0.47) NOD1GLP1RNMT2NMT1GLO1
SCHEMBL16156108 0.95 NOD1 (0.49) NOD1GLP1RNMT2NMT1GLO1
SCHEMBL16156102 0.95 NOD1 (0.49) NOD1GLP1RNMT2NMT1GLO1
SCHEMBL17682348 0.94 NOD1 (0.52) NOD1GLP1RNMT2NMT1GLO1
SCHEMBL21100058 0.93 NMT1 (0.47) NOD1GLP1RNMT2NMT1GLO1
SCHEMBL17375884 0.93 NMT1 (0.47) NOD1GLP1RNMT2NMT1GLO1
SCHEMBL16712658 0.92 NOD1 (0.39) NOD1GLP1RNMT2NMT1GLO1
SCHEMBL23964037 0.91 TLR2 (0.45) NOD1NMT2NMT1GLO1PTGS1
SCHEMBL19867245 0.91 NMT1 (0.49) NOD1GLP1RNMT2NMT1GLO1
SCHEMBL19308014 0.91 NMT1 (0.49) NOD1GLP1RNMT2NMT1GLO1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2021214220-A1 GLUCAGON ANALOGUES AS LONG-ACTING GLP-1/GLUCAGON RECEPTOR AGONISTS IN THE TREATMENT OF FATTY LIVER DISEASE AND STEATOHEPATITIS BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2021-10-28 — — WO disclosed
EP-3065767-B1 GIP-GLP-1 DUAL AGONIST COMPOUNDS AND METHODS ZEALAND PHARMA AS (DK) 2020-12-30 — — EP disclosed
EP-3057984-B1 ACYLATED GLUCAGON ANALOGUES ZEALAND PHARMA AS (DK) 2018-07-11 — — EP disclosed
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