SCHEMBL2649059

SCHEMBL2649059

[CH]c1cc(OC)c(OCc2ccc(C(C)C)cc2)c(OC)c1

nearest known ligand 0.50

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
GCGR P47871 14/20 0.50
ADCYAP1R1 P41586 1/20 0.46
IDO1 P14902 2/20 0.45
COL1A1 P02452 1/20 0.43
RXRA P19793 1/20 0.41
RXRB P28702 1/20 0.41

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
SCHEMBL28743047 0.86 GCGR (0.51) GCGRADCYAP1R1IDO1COL1A1RXRA
SCHEMBL17129257 0.85 GCGR (0.50) GCGRADCYAP1R1IDO1
SCHEMBL2650257 0.81 ALDH1A1 (0.59) GCGRADCYAP1R1
SCHEMBL17129362 0.79 GCGR (0.44) GCGRADCYAP1R1COL1A1
SCHEMBL7235710 0.78 GCGR (0.61) GCGRADCYAP1R1
SCHEMBL27517422 0.78 ACHE (0.50) GCGRADCYAP1R1IDO1
SCHEMBL7235715 0.77 GCGR (0.60) GCGRADCYAP1R1RXRARXRB
SCHEMBL27517753 0.75 COL1A1 (0.44) GCGRADCYAP1R1IDO1COL1A1RXRA
SCHEMBL22858195 0.73 MAPK1 (0.47) GCGRIDO1
SCHEMBL2650562 0.71 ALDH1A1 (0.79) GCGRADCYAP1R1

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-0994848-A1 GLUCAGON ANTAGONISTS/INVERSE AGONISTS NOVO NORDISK A/S (DK) 2000-04-26 EP disclosed
WO-1999001423-A1 GLUCAGON ANTAGONISTS/INVERSE AGONISTS NOVO NORDISK A/S (DK) 1999-01-14 WO disclosed