SCHEMBL15975845

SCHEMBL15975845

CCCNC(=O)CC[C@H](NC(=O)CCCCCCCCCOc1ccc(C(=O)O)cc1)C(=O)O

nearest known ligand 0.54

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ ITGB3 P05106 2/20 0.54
▸ ITGA2B P08514 2/20 0.54
▸ TP53 P04637 1/20 0.52
▸ TSHR P16473 1/20 0.52
▸ PLA2G4B P0C869 6/20 0.51
▸ NOD1 Q9Y239 2/20 0.50
▸ RARB P10826 3/20 0.49
▸ CNR1 P21554 1/20 0.47
▸ CNR2 P34972 1/20 0.47
▸ PLA2G4A P47712 1/20 0.47
▸ GLP1R P43220 3/20 0.47

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
SCHEMBL12499995 1.00 ITGB3 (0.54) ITGB3ITGA2BTP53TSHRPLA2G4B
SCHEMBL18697439 0.96 ITGB3 (0.57) ITGB3ITGA2BTP53TSHRPLA2G4B
SCHEMBL20146949 0.96 ITGB3 (0.57) ITGB3ITGA2BTP53TSHRPLA2G4B
SCHEMBL18697434 0.96 ITGB3 (0.57) ITGB3ITGA2BTP53TSHRPLA2G4B
SCHEMBL14725963 0.93 ITGB3 (0.54) ITGB3ITGA2BTP53TSHRPLA2G4B
SCHEMBL20652774 0.92 ITGB3 (0.53) ITGB3ITGA2BTP53TSHRPLA2G4B
SCHEMBL17244041 0.92 GLP1R (0.53) ITGB3ITGA2BTP53TSHRPLA2G4B
SCHEMBL24652677 0.92 GLP1R (0.59) ITGB3ITGA2BTP53TSHRPLA2G4B
SCHEMBL12497136 0.92 GLP1R (0.59) ITGB3ITGA2BTP53TSHRPLA2G4B
SCHEMBL12496872 0.92 GLP1R (0.59) ITGB3ITGA2BTP53TSHRPLA2G4B

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-8815802-B2 GLP-1 analogues and derivatives NOVO NORDISK A/S (DK) 2014-08-26 — — US disclosed
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