SCHEMBL2646622

SCHEMBL2646622

COc1cc(NC(=O)CCc2ccc(Cl)cc2)ccc1/C=N/NC(=O)c1ccc(O)c(Cl)c1

nearest known ligand 0.84

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
GCGR P47871 17/20 0.84
ALDH1A1 P00352 2/20 0.54
KDM4E B2RXH2 1/20 0.54
MAPT P10636 1/20 0.54
RAB9A P51151 1/20 0.54
BLM P54132 1/20 0.54
SMN1; SMN2 Q16637 1/20 0.54
CTDSP1 Q9GZU7 1/20 0.54
HPGD P15428 1/20 0.51
ADCYAP1R1 P41586 2/20 0.49

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
SCHEMBL2646623 1.00 GCGR (0.84) GCGRALDH1A1KDM4EMAPTRAB9A
SCHEMBL9071649 0.92 GCGR (0.71) GCGRALDH1A1KDM4EMAPTRAB9A
SCHEMBL2646990 0.91 GCGR (0.80) GCGRALDH1A1KDM4EMAPTRAB9A
SCHEMBL2646988 0.91 GCGR (0.80) GCGRALDH1A1KDM4EMAPTRAB9A
SCHEMBL7235361 0.91 GCGR (1.00) GCGRALDH1A1HPGDADCYAP1R1
SCHEMBL7235356 0.91 GCGR (1.00) GCGRALDH1A1HPGDADCYAP1R1
SCHEMBL7229348 0.90 GCGR (0.85) GCGRALDH1A1KDM4EMAPTRAB9A
SCHEMBL7229343 0.90 GCGR (0.85) GCGRALDH1A1KDM4EMAPTRAB9A
SCHEMBL7238626 0.86 GCGR (0.67) GCGRALDH1A1KDM4EMAPTRAB9A
SCHEMBL7238629 0.86 GCGR (0.67) GCGRALDH1A1KDM4EMAPTRAB9A

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 7 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
WO-2000039088-A1 GLUCAGON ANTAGONISTS/INVERSE AGONISTS NOVO NORDISK A/S (DK) 2000-07-06 WO disclosed