SCHEMBL2645708

SCHEMBL2645708

COc1cc(NC(=O)Cc2cccc(Cl)c2)ccc1/C=N/NC(=O)c1ccc(O)c(Cl)c1

nearest known ligand 0.68

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
GCGR P47871 14/20 0.68
ALDH1A1 P00352 3/20 0.54
RAB9A P51151 2/20 0.54
SMN1; SMN2 Q16637 2/20 0.54
KDM4E B2RXH2 1/20 0.54
MAPT P10636 1/20 0.54
BLM P54132 1/20 0.54
CTDSP1 Q9GZU7 1/20 0.54
ADCYAP1R1 P41586 1/20 0.53
SGK1 O00141 1/20 0.52
NPC1 O15118 1/20 0.51
HPGD P15428 1/20 0.51

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
SCHEMBL2645711 1.00 GCGR (0.68) GCGRALDH1A1RAB9ASMN1; SMN2KDM4E
SCHEMBL2646988 0.91 GCGR (0.80) GCGRALDH1A1RAB9ASMN1; SMN2KDM4E
SCHEMBL2646990 0.91 GCGR (0.80) GCGRALDH1A1RAB9ASMN1; SMN2KDM4E
SCHEMBL7239651 0.90 GCGR (0.80) GCGRADCYAP1R1
SCHEMBL7239653 0.90 GCGR (0.80) GCGRADCYAP1R1
SCHEMBL7228347 0.90 GCGR (0.69) GCGRALDH1A1RAB9ASMN1; SMN2KDM4E
SCHEMBL7228351 0.90 GCGR (0.69) GCGRALDH1A1RAB9ASMN1; SMN2KDM4E
SCHEMBL2647968 0.90 GCGR (0.85) GCGRALDH1A1RAB9ASMN1; SMN2KDM4E
SCHEMBL2647970 0.90 GCGR (0.85) GCGRALDH1A1RAB9ASMN1; SMN2KDM4E
SCHEMBL2646623 0.85 GCGR (0.84) GCGRALDH1A1RAB9ASMN1; SMN2KDM4E

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 6 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6613942-B1 Nonpeptide; 4-hydroxy benzoic acid hydrazides NOVO NORDISK A/S (DK) 2003-09-02 US claimed
EP-1140823-A1 GLUCAGON ANTAGONISTS/INVERSE AGONISTS NOVO NORDISK A/S (DK) 2001-10-10 EP claimed
WO-2000039088-A1 GLUCAGON ANTAGONISTS/INVERSE AGONISTS NOVO NORDISK A/S (DK) 2000-07-06 WO claimed
US-6613942-B1 Nonpeptide; 4-hydroxy benzoic acid hydrazides NOVO NORDISK A/S (DK) 2003-09-02 US disclosed
EP-1140823-A1 GLUCAGON ANTAGONISTS/INVERSE AGONISTS NOVO NORDISK A/S (DK) 2001-10-10 EP disclosed
WO-2000039088-A1 GLUCAGON ANTAGONISTS/INVERSE AGONISTS NOVO NORDISK A/S (DK) 2000-07-06 WO disclosed