SCHEMBL2663309

SCHEMBL2663309

N=N/C(=N\N)NC(=O)c1ccc(CN(C(=O)Cc2ccc3ccccc3c2)c2ccc(C3CCCCC3)cc2)cc1

nearest known ligand 0.46

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
STAT3 P40763 10/20 0.46
GCGR P47871 8/20 0.42
GIPR P48546 6/20 0.42
PTPN2 P17706 1/20 0.40
PTPN1 P18031 1/20 0.40
PTPRS Q13332 1/20 0.40
MAPK14 Q16539 1/20 0.38
HDAC1 Q13547 1/20 0.38
HDAC6 Q9UBN7 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
SCHEMBL2663367 0.89 STAT3 (0.47) STAT3GCGRGIPRHDAC1HDAC6
SCHEMBL2663354 0.86 GCGR (0.50) STAT3GCGRGIPR
SCHEMBL2663352 0.85 STAT3 (0.54) STAT3GCGRGIPRHDAC1HDAC6
SCHEMBL2663189 0.84 GCGR (0.57) STAT3GCGRGIPR
SCHEMBL2663358 0.83 STAT3 (0.55) STAT3GCGRGIPRHDAC1HDAC6
SCHEMBL2663321 0.83 STAT3 (0.49) STAT3GCGRGIPR
SCHEMBL2663582 0.83 STAT3 (0.45) STAT3GCGRGIPR
SCHEMBL2663379 0.83 STAT3 (0.45) STAT3GCGRGIPRPTPN2PTPN1
SCHEMBL2663183 0.83 GCGR (0.41) STAT3GCGRGIPRHDAC1HDAC6
SCHEMBL2653183 0.80 GCGR (0.64) STAT3GCGRGIPR

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