SCHEMBL2663584

SCHEMBL2663584

O=C(O)CCNC(=O)c1ccc(CN(C(=O)c2cc3cc(Cl)ccc3o2)C(c2ccccc2)c2ccccc2)cc1

nearest known ligand 0.63

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GCGR P47871 11/20 0.63
GLP1R P43220 1/20 0.48
HDAC3 O15379 2/20 0.44
HDAC1 Q13547 2/20 0.44
HDAC2 Q92769 2/20 0.44
HDAC4 P56524 1/20 0.43
HDAC7 Q8WUI4 1/20 0.43
HDAC10 Q969S8 1/20 0.43
HDAC11 Q96DB2 1/20 0.43
HDAC8 Q9BY41 1/20 0.43
HDAC6 Q9UBN7 1/20 0.43
HDAC9 Q9UKV0 1/20 0.43
HDAC5 Q9UQL6 1/20 0.43
ITGB3 P05106 3/20 0.40
ITGA2B P08514 3/20 0.40
TMEM97 Q5BJF2 1/20 0.40
SIGMAR1 Q99720 1/20 0.40
MEN1 O00255 1/20 0.40
KMT2A Q03164 1/20 0.40
BCAT1 P54687 1/20 0.40

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
SCHEMBL4087887 0.89 GCGR (0.52) GCGRGLP1RHDAC3HDAC1HDAC2
SCHEMBL4091957 0.75 GCGR (0.64) GCGRGLP1RHDAC3HDAC1HDAC2
SCHEMBL2662297 0.74 GCGR (0.54) GCGRGLP1RHDAC3HDAC1HDAC2
SCHEMBL2663009 0.73 GCGR (0.79) GCGRGLP1RHDAC3HDAC1HDAC7
SCHEMBL13800474 0.72 GCGR (0.61) GCGRGLP1RHDAC3HDAC1HDAC7
SCHEMBL2663347 0.70 GCGR (0.56) GCGRGLP1RHDAC3HDAC1HDAC2
SCHEMBL2663011 0.69 CXCR3 (0.53) GCGRGLP1RHDAC1TMEM97SIGMAR1
SCHEMBL4081595 0.68 GCGR (0.80) GCGRGLP1RTMEM97SIGMAR1GIPR
SCHEMBL2663201 0.68 GCGR (0.53) GCGRGLP1RTMEM97SIGMAR1KMT2A
SCHEMBL4926908 0.67 ALDH1A1 (0.51) MEN1KMT2ABCAT1

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