SCHEMBL30449460

SCHEMBL30449460

CC(C)C[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](N)CC(C)C)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@H](C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](Cc1ccccc1)C(=O)O)C(C)C

nearest known ligand 0.56

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ VIPR2 P41587 6/20 0.56
▸ VIPR1 P32241 4/20 0.56
▸ GLP1R P43220 5/20 0.54
▸ SCTR P47872 1/20 0.54
▸ TFPI P10646 1/20 0.54
▸ BACE1 P56817 4/20 0.52
▸ PTH1R Q03431 2/20 0.52
▸ MC4R P32245 1/20 0.50
▸ GCGR P47871 1/20 0.50

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
SCHEMBL29871066 0.98 VIPR2 (0.56) VIPR2VIPR1GLP1RSCTRTFPI
SCHEMBL29654742 0.92 BACE1 (0.59) VIPR2VIPR1BACE1
SCHEMBL29860256 0.91 PTH1R (0.61) GLP1RPTH1RGCGR
SCHEMBL31529444 0.91 NPY4R (0.52) VIPR2VIPR1GLP1RSCTRTFPI
SCHEMBL30974396 0.91 TFPI (0.60) VIPR2VIPR1GLP1RSCTRTFPI
SCHEMBL29526513 0.91 GLP1R (0.57) VIPR2VIPR1GLP1RSCTRTFPI
SCHEMBL31005069 0.90 TFPI (0.64) VIPR1GLP1RSCTRTFPIPTH1R
SCHEMBL30974518 0.90 TFPI (0.62) VIPR2VIPR1GLP1RSCTRTFPI
SCHEMBL29592929 0.90 TFPI (0.63) VIPR2VIPR1GLP1RSCTRTFPI
SCHEMBL29972780 0.90 TFPI (0.63) VIPR2VIPR1GLP1RSCTRTFPI

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-116338064-A Detection method of teriparatide 南京康舟医药科技有限公司 2023-06-27 — — CN claimed
CN-116338064-A Detection method of teriparatide 南京康舟医药科技有限公司 2023-06-27 — — CN disclosed
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