SCHEMBL30861917

SCHEMBL30861917

CC(C)C[C@H](NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CO)NC(=O)[C@H](CO)NC(=O)[C@@H](N)C(C)C)C(=O)N[C@@H](CCC(=O)O)C(=O)NCC(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](C)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCCN)C(=O)O

nearest known ligand 0.61

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ TFPI P10646 1/20 0.61
▸ NPBWR1 P48145 4/20 0.52
▸ GLP1R P43220 4/20 0.52
▸ OPRM1 P35372 2/20 0.51
▸ OPRD1 P41143 2/20 0.51
▸ OPRK1 P41145 2/20 0.51

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
SCHEMBL29526062 0.97 TFPI (0.64) TFPINPBWR1GLP1ROPRM1OPRD1
SCHEMBL30721576 0.94 TFPI (0.61) TFPINPBWR1OPRM1OPRD1OPRK1
SCHEMBL29375967 0.93 TFPI (0.59) TFPINPBWR1OPRM1OPRD1OPRK1
SCHEMBL30861920 0.92 TFPI (0.65) TFPIGLP1R
SCHEMBL29525489 0.91 TFPI (0.63) TFPINPBWR1OPRM1OPRD1OPRK1
SCHEMBL29373287 0.91 TFPI (0.66) TFPIGLP1ROPRM1OPRD1OPRK1
SCHEMBL29376362 0.90 TFPI (0.66) TFPIGLP1R
SCHEMBL29376413 0.90 TFPI (0.56) TFPINPBWR1OPRM1OPRD1OPRK1
SCHEMBL29679580 0.89 TFPI (0.58) TFPIGLP1ROPRM1OPRD1OPRK1
SCHEMBL30471367 0.89 NPY4R (0.54) TFPINPBWR1OPRM1OPRD1OPRK1

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
WO-2024068827-A1 METHOD FOR PREPARING LIRAGLUTIDE BACHEM HOLDING AG (CH) 2024-04-04 — — WO claimed
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