SCHEMBL2665070

SCHEMBL2665070

O=C(O)CCNC(=O)c1ccc(C(=O)/C(=C\C(=O)c2ccc(SC(F)(F)F)cc2)c2ccc(-c3ccccc3)cc2)cc1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GCGR P47871 6/20 0.47
GIPR P48546 1/20 0.44
CHRM4 P08173 1/20 0.43
KCNK2 O95069 2/20 0.41
KCNK10 P57789 1/20 0.41
EPHX2 P34913 1/20 0.40
NR1H4 Q96RI1 1/20 0.40
ADCY6 O43306 2/20 0.39
ADCY3 O60266 2/20 0.39
ADCY9 O60503 2/20 0.39
ADCY5 O95622 2/20 0.39
ADCY8 P40145 2/20 0.39
ADCY7 P51828 2/20 0.39
ADCY2 Q08462 2/20 0.39
ADCY1 Q08828 2/20 0.39
ADCY4 Q8NFM4 2/20 0.39
NPC1 O15118 1/20 0.39
RAB9A P51151 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
HDAC3 O15379 1/20 0.39

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
SCHEMBL2647087 0.87 GCGR (0.47) GCGRGIPRKCNK2KCNK10ADCY6
SCHEMBL2647091 0.87 GCGR (0.47) GCGRGIPRKCNK2KCNK10ADCY6
SCHEMBL9071390 0.85 GCGR (0.42) GCGRGIPRCHRM4KCNK2KCNK10
SCHEMBL2648042 0.84 GCGR (0.53) GCGRGIPR
SCHEMBL2648152 0.84 GCGR (0.53) GCGRGIPR
SCHEMBL2648150 0.84 GCGR (0.53) GCGRGIPR
SCHEMBL2665067 0.84 GCGR (0.55) GCGRGIPREPHX2NR1H4ADCY6
SCHEMBL2647432 0.83 GCG (0.54) GCGRGIPRNPC1RAB9ASMN1; SMN2
SCHEMBL2647438 0.83 GCG (0.54) GCGRGIPRNPC1RAB9ASMN1; SMN2
SCHEMBL2647088 0.83 GCGR (0.45) GCGRGIPRCHRM4EPHX2NR1H4

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