SCHEMBL6931475

SCHEMBL6931475

CCCCCCCCCCCC(=O)N[C@@H](CCC(=O)O)C(=O)NCCCC

nearest known ligand 0.61

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
NOD1 Q9Y239 1/20 0.60
PLA2G2C Q5R387 1/20 0.60
PLA2G10 O15496 1/20 0.59
GLP1R P43220 8/20 0.59
LPAR3 Q9UBY5 4/20 0.59
LPAR1 Q92633 2/20 0.57

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
SCHEMBL9517290 0.99 GLP1R (0.61) NOD1PLA2G2CGLP1RLPAR3LPAR1
SCHEMBL9441752 0.99 GLP1R (0.61) NOD1PLA2G2CGLP1RLPAR3LPAR1
SCHEMBL22684576 0.92 SIRT6 (0.63) GLP1RLPAR3LPAR1
SCHEMBL22684529 0.92 NOD1 (0.55) NOD1PLA2G2CPLA2G10GLP1RLPAR3
SCHEMBL14683578 0.91 NOD1 (0.52) NOD1PLA2G2CPLA2G10GLP1RLPAR3
SCHEMBL13339079 0.91 EPHX2 (0.66) GLP1R
SCHEMBL12148860 0.91 EPHX2 (0.66) GLP1R
SCHEMBL6809578 0.90 NOD1 (0.58) NOD1PLA2G2CPLA2G10GLP1R
SCHEMBL27935271 0.90 NOD1 (0.58) NOD1PLA2G2CPLA2G10GLP1R
SCHEMBL13336948 0.90 GLP1R (0.64) NOD1GLP1RLPAR3LPAR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1295808-A2 Protective container and associated methods Hewlett-Packard Company (US) 2003-03-26 EP disclosed
US-20030052036-A1 Protective container and associated methods HEWLETT-PACKARD DEVELOPMENT COMPANY L.P. 2003-03-20 US disclosed