SCHEMBL2655487

SCHEMBL2655487

Cc1ccc(-c2ccc(SCC(C)CCc3ccc(C(=O)NCCC(=O)O)cc3)cc2)cc1C

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GCG P01275 3/20 0.60
PTAFR P25105 1/20 0.43
HRH3 Q9Y5N1 1/20 0.43
PSEN1 P49768 1/20 0.41
PSEN2 P49810 1/20 0.41
APH1B Q8WW43 1/20 0.41
NCSTN Q92542 1/20 0.41
APH1A Q96BI3 1/20 0.41
PSENEN Q9NZ42 1/20 0.41
GCGR P47871 8/20 0.40
NPC1 O15118 2/20 0.40
RAB9A P51151 2/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
TP53 P04637 1/20 0.39
POLB P06746 1/20 0.39
MAPT P10636 1/20 0.39
ADCY6 O43306 1/20 0.38
ADCY3 O60266 1/20 0.38
ADCY9 O60503 1/20 0.38
ADCY5 O95622 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
SCHEMBL2654712 0.87 GCG (0.47) GCGHRH3GCGRNPC1RAB9A
SCHEMBL2655306 0.86 HRH3 (0.43) GCGHRH3GCGRNPC1RAB9A
SCHEMBL2654684 0.86 GCGR (0.47) GCGHRH3GCGRADCY6ADCY3
SCHEMBL2654700 0.85 MMP12 (0.45) GCGHRH3GCGRNPC1RAB9A
SCHEMBL2653257 0.83 GCG (0.42) GCGHRH3GCGRNPC1RAB9A
SCHEMBL2654574 0.83 GCG (0.57) GCGPTAFRHRH3PSEN1PSEN2
SCHEMBL2656081 0.83 GCGR (0.55) GCGRADCY6ADCY3ADCY9ADCY5
SCHEMBL2655295 0.83 FOLH1 (0.44) GCGHRH3GCGRNPC1RAB9A
SCHEMBL2654473 0.82 GCGR (0.54) GCGGCGRNPC1RAB9AADCY6
SCHEMBL2653963 0.81 CD274 (0.48) GCGHRH3GCGR

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-1758853-A1 GLUCAGON RECEPTOR ANTAGONISTS, PREPARATION AND THERAPEUTIC USES ELI LILLY AND COMPANY (US) 2007-03-07 EP disclosed
WO-2005123668-A1 GLUCAGON RECEPTOR ANTAGONISTS, PREPARATION AND THERAPEUTIC USES ELI LILLY AND COMPANY (US) 2005-12-29 WO disclosed