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SCHEMBL2652065

SCHEMBL2652065

O=C(CCNC(=O)c1ccc(CN(C(=O)Nc2cccc(OC(F)(F)F)c2)c2ccc(C3=CCCCC3)cc2)cc1)OC(=O)CCNC(=O)c1ccc(CN(C(=O)Nc2cccc(OC(F)(F)F)c2)C2CCC(C3CCCCC3)CC2)cc1

nearest known ligand 0.51

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ GCGR P47871 20/20 0.51
▸ GIPR P48546 9/20 0.50
▸ GLP1R P43220 3/20 0.50
▸ ADCY6 O43306 1/20 0.48
▸ ADCY3 O60266 1/20 0.48
▸ ADCY9 O60503 1/20 0.48
▸ ADCY5 O95622 1/20 0.48
▸ ADCY8 P40145 1/20 0.48
▸ ADCY7 P51828 1/20 0.48
▸ ADCY2 Q08462 1/20 0.48
▸ ADCY1 Q08828 1/20 0.48
▸ ADCY4 Q8NFM4 1/20 0.48

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
SCHEMBL2652062 0.94 GCGR (0.58) GCGRGIPRGLP1RADCY6ADCY3
SCHEMBL2651295 0.90 GCGR (0.64) GCGRGIPRGLP1R
SCHEMBL2652143 0.86 GCGR (0.59) GCGRGIPRGLP1RADCY6ADCY3
SCHEMBL2649621 0.84 GCGR (0.69) GCGRGIPRGLP1R
SCHEMBL2651291 0.84 GCGR (0.73) GCGRGIPRGLP1R
SCHEMBL2666011 0.83 GCGR (0.68) GCGRGIPRGLP1RADCY6ADCY3
SCHEMBL9071331 0.79 GCGR (0.59) GCGRGIPRGLP1R
SCHEMBL2651117 0.78 GCGR (0.59) GCGRGIPRGLP1R
SCHEMBL2665561 0.78 GCGR (0.66) GCGRGIPRGLP1R
SCHEMBL2665528 0.78 GCGR (0.77) GCGRGIPRGLP1R

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-2002040444-A1 GLUCAGON ANTAGONISTS/INVERSE AGONISTS NOVO NORDISK A/S (DK) 2002-05-23 — — WO claimed