SCHEMBL21923099

SCHEMBL21923099

CC(=O)COCCOCCNC(=O)CCCNC(=O)CCC(NC(=O)CCCNC(C)C)C(=O)O

nearest known ligand 0.57

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
GLP1R P43220 8/20 0.57
NOD1 Q9Y239 5/20 0.43
EPHX2 P34913 1/20 0.40
GLO1 Q04760 1/20 0.39
FOLH1 Q04609 2/20 0.37
ALB P02768 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
SCHEMBL21318204 0.89 GLP1R (0.55) GLP1RNOD1EPHX2GLO1FOLH1
SCHEMBL24265616 0.88 GLP1R (0.54) GLP1RNOD1EPHX2GLO1FOLH1
SCHEMBL20668106 0.88 GLP1R (0.54) GLP1RNOD1EPHX2GLO1FOLH1
SCHEMBL16478855 0.88 GLP1R (0.58) GLP1RNOD1EPHX2FOLH1ALB
SCHEMBL24352155 0.88 GLP1R (0.53) GLP1RNOD1EPHX2GLO1FOLH1
SCHEMBL24253206 0.87 GLP1R (0.60) GLP1RNOD1EPHX2GLO1FOLH1
SCHEMBL20665111 0.87 GLP1R (0.64) GLP1RNOD1GLO1FOLH1
SCHEMBL21099709 0.86 GLP1R (0.67) GLP1RNOD1EPHX2GLO1FOLH1
SCHEMBL21242829 0.86 GLP1R (0.67) GLP1RNOD1EPHX2GLO1FOLH1
SCHEMBL26020310 0.86 MEN1 (0.41) GLP1R

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
EP-3405208-B1 COMPOUNDS AND METHODS FOR TREATING INFLAMMATION TUFTS MEDICAL CT INC (US) 2020-04-29 EP disclosed