SCHEMBL29555982

SCHEMBL29555982

CSCC[C@H](NC(=O)[C@H](C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)CNC(=O)[C@@H](N)CCCNC(=N)N)C(=O)N[C@H](C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](C)C(=O)N1CCC[C@H]1C(=O)O)C(C)C

nearest known ligand 0.57

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ OPRM1 P35372 6/20 0.50
▸ OPRK1 P41145 6/20 0.50
▸ APLNR P35414 1/20 0.49
▸ CTSL P07711 2/20 0.49
▸ CTSS P25774 2/20 0.49
▸ CTSK P43235 2/20 0.49
▸ KEAP1 Q14145 1/20 0.48
▸ TFPI P10646 2/20 0.48
▸ NMUR2 Q9GZQ4 1/20 0.48
▸ NMUR1 Q9HB89 1/20 0.48
▸ MAPK8 P45983 1/20 0.48
▸ MAPK9 P45984 1/20 0.48
▸ MAPK10 P53779 1/20 0.48
▸ EPHA2 P29317 1/20 0.48
▸ CTSH P09668 1/20 0.47

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
SCHEMBL30393126 0.99 OPRM1 (0.50) OPRM1OPRK1APLNRCTSLCTSS
SCHEMBL30393094 0.91 OPRK1 (0.51) OPRM1OPRK1APLNRMAPK8MAPK9
SCHEMBL30686756 0.87 CALCR (0.56) KEAP1TFPIMAPK8MAPK9MAPK10
SCHEMBL29949738 0.86 EPHA2 (0.55) OPRM1OPRK1KEAP1TFPINMUR2
SCHEMBL30974393 0.82 NMUR2 (0.61) TFPINMUR2NMUR1
SCHEMBL31433170 0.82 APLNR (0.57) OPRM1OPRK1APLNRMAPK8MAPK9
SCHEMBL31384595 0.82 NPY4R (0.60) OPRM1OPRK1
SCHEMBL31384592 0.82 NPY4R (0.60) OPRM1OPRK1
SCHEMBL30973999 0.82 NMUR2 (0.58) APLNRTFPINMUR2NMUR1
SCHEMBL31261771 0.82 TFPI (0.56) TFPI

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-114315965-A Anti-obesity peptides and uses thereof 华南理工大学 2022-04-12 — — CN claimed
CN-114315965-B Anti-obesity peptides and uses thereof 华南理工大学 2023-05-12 — — CN disclosed
CN-114315965-A Anti-obesity peptides and uses thereof 华南理工大学 2022-04-12 — — CN disclosed
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