SCHEMBL2651297

SCHEMBL2651297

O=C(O)CCNC(=O)c1ccc(C(NC(=O)Nc2cccc(OC(F)(F)F)c2)c2ccc(C3=CCCCC3)cc2)cc1.O=C(O)CCNC(=O)c1ccc(C(NC(=O)Nc2cccc(OC(F)(F)F)c2)c2ccc(C3CCCCC3)cc2)cc1

nearest known ligand 0.51

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
GCGR P47871 18/20 0.51
GIPR P48546 4/20 0.45
CXCR3 P49682 1/20 0.45
MCHR1 Q99705 1/20 0.42
GLP1R P43220 2/20 0.41
ADCY6 O43306 1/20 0.39
ADCY3 O60266 1/20 0.39
ADCY9 O60503 1/20 0.39
ADCY5 O95622 1/20 0.39
ADCY8 P40145 1/20 0.39
ADCY7 P51828 1/20 0.39
ADCY2 Q08462 1/20 0.39
ADCY1 Q08828 1/20 0.39
ADCY4 Q8NFM4 1/20 0.39

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
SCHEMBL6752116 0.93 GCGR (0.50) GCGRGIPRCXCR3MCHR1GLP1R
SCHEMBL2651183 0.92 GCGR (0.55) GCGRGIPRCXCR3MCHR1GLP1R
SCHEMBL2652068 0.89 GCGR (0.43) GCGRGIPRCXCR3MCHR1GLP1R
SCHEMBL2651118 0.88 GCGR (0.47) GCGRGIPRGLP1R
SCHEMBL7101508 0.86 GCGR (0.45) GCGRGIPRMCHR1GLP1R
SCHEMBL2651291 0.85 GCGR (0.73) GCGRGIPRGLP1R
SCHEMBL2650524 0.84 GCGR (0.46) GCGRGIPRCXCR3GLP1R
SCHEMBL2650683 0.84 GCGR (0.49) GCGRGIPRGLP1RADCY6ADCY3
SCHEMBL4095266 0.83 GCGR (0.66) GCGRGIPRGLP1RADCY6ADCY3
SCHEMBL2650786 0.82 GCGR (0.42) GCGRGIPRGLP1RADCY6ADCY3

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
WO-2002040444-A1 GLUCAGON ANTAGONISTS/INVERSE AGONISTS NOVO NORDISK A/S (DK) 2002-05-23 WO claimed
WO-2002040444-A1 GLUCAGON ANTAGONISTS/INVERSE AGONISTS NOVO NORDISK A/S (DK) 2002-05-23 WO disclosed