SCHEMBL2662298

SCHEMBL2662298

O=C(O)CCNC(=O)c1ccc(C(Nc2ccc(C3CCCCC3)cc2)C(=O)c2cc3cc(Cl)ccc3o2)cc1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GCG P01275 4/20 0.41
GCGR P47871 9/20 0.41
CTSL P07711 1/20 0.40
CTSS P25774 1/20 0.40
CTSK P43235 1/20 0.40
SERPINE1 P05121 1/20 0.40
GIPR P48546 2/20 0.39
HDAC3 O15379 2/20 0.39
HDAC1 Q13547 2/20 0.39
HDAC2 Q92769 2/20 0.39
HDAC4 P56524 1/20 0.39
HDAC7 Q8WUI4 1/20 0.39
HDAC10 Q969S8 1/20 0.39
HDAC11 Q96DB2 1/20 0.39
HDAC8 Q9BY41 1/20 0.39
HDAC6 Q9UBN7 1/20 0.39
HDAC9 Q9UKV0 1/20 0.39
HDAC5 Q9UQL6 1/20 0.39
EPHX2 P34913 1/20 0.38
CYP2D6 P10635 1/20 0.38

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
SCHEMBL2662297 0.79 GCGR (0.54) GCGRSERPINE1GIPRHDAC3HDAC1
SCHEMBL2661746 0.72 GCGR (0.48) GCGRSERPINE1GIPRCYP2D6
SCHEMBL2665081 0.70 GCGR (0.49) GCGRSERPINE1GIPRCYP2D6
SCHEMBL4096042 0.70 GCGR (0.49) GCGRSERPINE1GIPREPHX2CYP2D6
SCHEMBL2659967 0.70 GCGR (0.47) GCGRSERPINE1GIPRCYP2D6
SCHEMBL2665105 0.70 GCGR (0.55) GCGRGIPRADCY6ADCY3ADCY9
SCHEMBL2650399 0.70 GCGR (0.50) GCGRSERPINE1GIPREPHX2CYP2D6
SCHEMBL2665028 0.70 GCGR (0.59) GCGRSERPINE1GIPRADCY6ADCY3
SCHEMBL2665188 0.70 BCL2L1 (0.48) GCGRGIPREPHX2CYP2D6ADCY6
SCHEMBL4096282 0.70 GCGR (0.46) GCGRSERPINE1GIPRCYP2D6

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-1183229-A1 GLUCAGON ANTAGONISTS/INVERSE AGONISTS NOVO NORDISK A/S (DK) 2002-03-06 EP disclosed
WO-2000069810-A1 GLUCAGON ANTAGONISTS/INVERSE AGONISTS NOVO NORDISK A/S (DK) 2000-11-23 WO disclosed