SCHEMBL30422395

SCHEMBL30422395

C[C@H](N)C(=O)NCC(=O)NCC(=O)N1CCC[C@H]1C(=O)N[C@@H](COC(C)(C)C)C(=O)N[C@@H](COC(C)(C)C)C(=O)NCC(=O)N[C@@H](C)C(=O)N1CCC[C@H]1C(=O)N1CCC[C@H]1C(=O)N1CCC[C@H]1C(=O)N[C@@H](COC(C)(C)C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)O

nearest known ligand 0.45

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ GRB2 P62993 1/20 0.44
▸ RAMP3 O60896 13/20 0.42
▸ CALCR P30988 13/20 0.42
▸ NMUR2 Q9GZQ4 3/20 0.40
▸ NMUR1 Q9HB89 3/20 0.40
▸ APLNR P35414 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
SCHEMBL30422608 0.92 GRB2 (0.42) GRB2RAMP3CALCRAPLNR
SCHEMBL30423238 0.92 GRB2 (0.46) GRB2RAMP3CALCRNMUR2NMUR1
SCHEMBL30543476 0.91 GRB2 (0.44) GRB2APLNR
SCHEMBL29468889 0.91 GRB2 (0.42) GRB2APLNR
SCHEMBL31501249 0.88 APLNR (0.41) GRB2APLNR
SCHEMBL30744330 0.87 GRB2 (0.41) GRB2APLNR
SCHEMBL38651991 0.86 APLNR (0.43) GRB2APLNR
SCHEMBL30744292 0.85 APLNR (0.42) GRB2APLNR
SCHEMBL29468804 0.85 GRB2 (0.41) GRB2APLNR
SCHEMBL31197908 0.85 APLNR (0.44) GRB2APLNR

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
EP-4146248-A1 LONG ACTING GLP-1/GIP DUAL AGONISTS Sun Pharmaceutical Industries Limited (IN) 2023-03-15 — — EP disclosed
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