SCHEMBL2665077

SCHEMBL2665077

O=C(O)CCNC(=O)c1ccc(C(=O)/C(=C\C(=O)c2cc(C(F)(F)F)cc(C(F)(F)F)c2)c2ccc(OC(F)(F)F)cc2)cc1

nearest known ligand 0.50

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
GCGR P47871 18/20 0.50
GIPR P48546 5/20 0.47
CYP3A4 P08684 1/20 0.47
CYP2C8 P10632 1/20 0.47
CYP2C9 P11712 1/20 0.47
KCNH2 Q12809 1/20 0.47
ADCY6 O43306 2/20 0.46
ADCY3 O60266 2/20 0.46
ADCY9 O60503 2/20 0.46
ADCY5 O95622 2/20 0.46
ADCY8 P40145 2/20 0.46
ADCY7 P51828 2/20 0.46
ADCY2 Q08462 2/20 0.46
ADCY1 Q08828 2/20 0.46
ADCY4 Q8NFM4 2/20 0.46
GLP1R P43220 2/20 0.45
PPARD Q03181 1/20 0.44
TRPV1 Q8NER1 1/20 0.43

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
SCHEMBL2647920 0.91 GCGR (0.53) GCGRGIPRCYP3A4CYP2C8CYP2C9
SCHEMBL2647916 0.91 GCGR (0.53) GCGRGIPRCYP3A4CYP2C8CYP2C9
SCHEMBL2665227 0.89 GCGR (0.57) GCGRGIPRCYP3A4CYP2C8CYP2C9
SCHEMBL2647843 0.88 TRPV1 (0.51) GCGRGIPRCYP3A4CYP2C8CYP2C9
SCHEMBL2647844 0.88 TRPV1 (0.51) GCGRGIPRCYP3A4CYP2C8CYP2C9
SCHEMBL2661127 0.87 GCGR (0.57) GCGRGIPRCYP3A4CYP2C8CYP2C9
SCHEMBL2655401 0.87 GCGR (0.57) GCGRGIPRCYP3A4CYP2C8CYP2C9
SCHEMBL2661122 0.87 GCGR (0.57) GCGRGIPRCYP3A4CYP2C8CYP2C9
SCHEMBL2655403 0.87 GCGR (0.57) GCGRGIPRCYP3A4CYP2C8CYP2C9
SCHEMBL6917434 0.86 GCGR (0.50) GCGRGIPRCYP3A4CYP2C8CYP2C9

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