SCHEMBL30637755

SCHEMBL30637755

CSCC[C@H](NC(=O)[C@H](CO)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](CCCCN)NC(=O)CN)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@H](C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(C)C)C(=O)O)C(C)C

nearest known ligand 0.62

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ PTH1R Q03431 15/20 0.62
▸ RXFP1 Q9HBX9 1/20 0.61
▸ GLP1R P43220 1/20 0.60
▸ GCGR P47871 1/20 0.60
▸ GIPR P48546 1/20 0.60
▸ GRPR P30550 1/20 0.57

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
SCHEMBL30763287 0.95 PTH1R (0.67) PTH1RRXFP1GLP1RGCGRGIPR
SCHEMBL30466631 0.94 PTH1R (0.68) PTH1RRXFP1GLP1RGCGR
SCHEMBL29407365 0.91 PTH1R (0.68) PTH1RGLP1RGCGRGIPR
SCHEMBL31473045 0.90 PTH1R (0.73) PTH1RRXFP1GLP1RGCGR
SCHEMBL30763299 0.90 PTH1R (0.73) PTH1RRXFP1GLP1RGCGR
SCHEMBL30136453 0.90 PTH1R (0.69) PTH1RGLP1RGCGRGIPR
SCHEMBL30449343 0.89 PTH1R (0.77) PTH1RRXFP1GLP1R
SCHEMBL30449142 0.89 PTH1R (0.77) PTH1RRXFP1GLP1R
SCHEMBL31041075 0.89 PTH1R (0.67) PTH1RRXFP1GLP1RGCGRGIPR
SCHEMBL30712898 0.88 PTH1R (0.64) PTH1RGLP1RGCGRGIPR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-117098843-A Subtilisin variants and uses thereof 费森尤斯卡比有限公司 2023-11-21 — — CN claimed
CN-117098843-A Subtilisin variants and uses thereof 费森尤斯卡比有限公司 2023-11-21 — — CN disclosed
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