SCHEMBL9070788

SCHEMBL9070788

CCCCCCC(Nc1ccc(C(=O)N(C)CCC(=O)O)cc1)c1cc2cc(Cl)ccc2n1C1C=CC=C(C(F)(F)F)C1

nearest known ligand 0.38

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
GCGR P47871 18/20 0.38
GIPR P48546 1/20 0.38
KCNH2 Q12809 1/20 0.38
GCG P01275 1/20 0.32
ADCY6 O43306 1/20 0.31
ADCY3 O60266 1/20 0.31
ADCY9 O60503 1/20 0.31
ADCY5 O95622 1/20 0.31
ADCY8 P40145 1/20 0.31
ADCY7 P51828 1/20 0.31
ADCY2 Q08462 1/20 0.31
ADCY1 Q08828 1/20 0.31
ADCY4 Q8NFM4 1/20 0.31
OXER1 Q8TDS5 1/20 0.30

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
SCHEMBL9070789 0.84 GCGR (0.40) GCGRGIPRKCNH2ADCY6ADCY3
SCHEMBL721555 0.80 GCGR (0.55) GCGRGIPRKCNH2GCG
SCHEMBL719157 0.76 GCGR (0.51) GCGRGIPRKCNH2
SCHEMBL717614 0.75 CCKBR (0.38) GCGRGIPRKCNH2GCGADCY6
SCHEMBL3397752 0.73 CCKBR (0.39) GCGRGIPRKCNH2GCGOXER1
SCHEMBL719164 0.69 GCGR (0.55) GCGRGIPRKCNH2OXER1
SCHEMBL716441 0.69 GCGR (0.53) GCGRGIPRKCNH2
SCHEMBL718652 0.68 OXER1 (0.48) OXER1
SCHEMBL27852299 0.66 ITGB3 (0.47) GCGRGIPRKCNH2GCGADCY6
SCHEMBL717989 0.59 KMT2A (0.43) GCG

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-2009110520-A1 HETEROCYCLIC COMPOUND 武田薬品工業株式会社 (JP) 2009-09-11 WO disclosed