SCHEMBL23839871

SCHEMBL23839871

CC(=O)C(N)CCCCNC(=O)COCCOCCNC(=O)COCCOCCNC(=O)CCCNC(=O)CCCCCCCCCCCCCCCCC(=O)O

nearest known ligand 0.52

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ GLP1R P43220 8/20 0.52
▸ NOD1 Q9Y239 1/20 0.42
▸ EPHX2 P34913 3/20 0.40
▸ ADRA1A P35348 1/20 0.40
▸ EPOR P19235 1/20 0.39
▸ TLR2 O60603 1/20 0.38
▸ KDM4E B2RXH2 1/20 0.38
▸ ITGB3 P05106 1/20 0.37
▸ ITGA2B P08514 1/20 0.37
▸ FOLH1 Q04609 2/20 0.36

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
SCHEMBL16947980 0.99 GLP1R (0.53) GLP1RNOD1EPHX2ADRA1AEPOR
SCHEMBL20652648 0.91 GLP1R (0.54) GLP1RNOD1EPHX2EPORITGB3
SCHEMBL20653022 0.91 GLP1R (0.54) GLP1RNOD1EPHX2EPORITGB3
SCHEMBL20652822 0.91 GLP1R (0.54) GLP1RNOD1EPHX2EPORITGB3
SCHEMBL20652766 0.91 GLP1R (0.54) GLP1RNOD1EPHX2EPORITGB3
SCHEMBL24890886 0.90 GLP1R (0.67) GLP1RNOD1FOLH1
SCHEMBL16638273 0.90 GLP1R (0.67) GLP1RNOD1FOLH1
SCHEMBL24891117 0.90 GLP1R (0.67) GLP1RNOD1FOLH1
SCHEMBL16947959 0.90 GLP1R (0.67) GLP1RNOD1FOLH1
SCHEMBL16947828 0.90 GLP1R (0.67) GLP1RNOD1FOLH1

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-2021186169-A1 ORAL GLP RECEPTOR AGONISTS HEPTARES THERAPEUTICS LIMITED (GB) 2021-09-23 — — WO disclosed
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