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Sugi Predict / Compounds / SCHEMBL2650176

SCHEMBL2650176

SCHEMBL2650176

O=C(CCNC(=O)c1ccc(CN(C(=O)Nc2nc3cc(OC(F)(F)F)ccc3s2)c2ccc(C3=CCCCC3)cc2)cc1)OC(=O)CCNC(=O)c1ccc(CN(C(=O)Nc2nc3cc(Cl)cc(Cl)c3s2)c2ccc(C3=CCCCC3)cc2)cc1

nearest known ligand 0.51

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ GCGR P47871 20/20 0.51
▸ GIPR P48546 19/20 0.51
▸ GLP1R P43220 5/20 0.51

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
SCHEMBL2650172 0.95 GCGR (0.58) GCGRGIPRGLP1R
SCHEMBL2663261 0.88 GCGR (0.64) GCGRGIPRGLP1R
SCHEMBL2663256 0.84 GCGR (0.72) GCGRGIPRGLP1R
SCHEMBL2650973 0.83 GCGR (0.62) GCGRGIPRGLP1R
SCHEMBL2665589 0.82 GCGR (0.62) GCGRGIPRGLP1R
SCHEMBL2650180 0.81 GCGR (0.49) GCGRGIPRGLP1R
SCHEMBL2663515 0.79 GCGR (0.49) GCGRGIPR
SCHEMBL6752774 0.79 GCGR (0.61) GCGRGIPRGLP1R
SCHEMBL2663314 0.78 GCGR (0.71) GCGRGIPRGLP1R
SCHEMBL2665573 0.78 GCGR (0.72) 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