SCHEMBL2665128

SCHEMBL2665128

CC(C)(C)c1ccc(C(=O)/C=C(\C(=O)c2ccc(C(=O)NC[C@@H](O)C(=O)O)cc2)c2ccc(-c3ccccc3)cc2)cc1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GCGR P47871 5/20 0.56
RAB9A P51151 4/20 0.44
LMNA P02545 1/20 0.44
NPC1 O15118 3/20 0.42
EGFR P00533 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.40
ADCY6 O43306 2/20 0.40
ADCY3 O60266 2/20 0.40
ADCY9 O60503 2/20 0.40
ADCY5 O95622 2/20 0.40
ADCY8 P40145 2/20 0.40
ADCY7 P51828 2/20 0.40
ADCY2 Q08462 2/20 0.40
ADCY1 Q08828 2/20 0.40
ADCY4 Q8NFM4 2/20 0.40
GIPR P48546 1/20 0.40
POLB P06746 1/20 0.40
CASP3 P42574 1/20 0.40
SENP7 Q9BQF6 1/20 0.40
MAPT P10636 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
SCHEMBL9071502 0.85 GCGR (0.51) GCGRGIPR
SCHEMBL6917344 0.84 GCGR (0.58) GCGRADCY6ADCY3ADCY9ADCY5
SCHEMBL2665219 0.84 GCGR (0.58) GCGRADCY6ADCY3ADCY9ADCY5
SCHEMBL6917347 0.84 GCGR (0.58) GCGRADCY6ADCY3ADCY9ADCY5
SCHEMBL2647008 0.84 GCGR (0.51) GCGRGIPR
SCHEMBL2647002 0.84 GCGR (0.51) GCGRGIPR
SCHEMBL9071390 0.84 GCGR (0.42) GCGRRAB9ANPC1SMN1; SMN2GIPR
SCHEMBL2665119 0.84 GCGR (0.51) GCGRGIPR
SCHEMBL2665067 0.83 GCGR (0.55) GCGRRAB9ALMNANPC1SMN1; SMN2
SCHEMBL2665036 0.83 GCGR (0.53) GCGRRAB9AGIPRACE

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-2003048109-A1 NOVEL GLUCAGON ANTAGONISTS NOVO NORDISK A/S (DK) 2003-06-12 WO disclosed