SCHEMBL30721587

SCHEMBL30721587

CSCC[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](C)N)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@H](C(=O)O)[C@@H](C)O

nearest known ligand 0.57

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ ERAP2 Q6P179 6/20 0.57
▸ KISS1R Q969F8 12/20 0.54
▸ IL1RN P18510 5/20 0.51
▸ ERAP1 Q9NZ08 4/20 0.51
▸ IL23R Q5VWK5 1/20 0.51
▸ MAGI3 Q5TCQ9 1/20 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
SCHEMBL29393516 0.93 ERAP2 (0.56) ERAP2KISS1RIL1RNERAP1
SCHEMBL29727424 0.93 ERAP2 (0.56) ERAP2KISS1RIL23RMAGI3
SCHEMBL29390396 0.92 MAGI3 (0.55) ERAP2KISS1RIL23RMAGI3
SCHEMBL28674492 0.91 IL23R (0.58) KISS1RIL23RMAGI3
SCHEMBL30301902 0.88 KISS1R (0.60) KISS1RIL23RMAGI3
SCHEMBL30108349 0.87 KISS1R (0.55) ERAP2KISS1RIL1RNERAP1IL23R
SCHEMBL29549608 0.86 KISS1R (0.57) KISS1RIL23RMAGI3
SCHEMBL29470182 0.86 ACE (0.57) ERAP2IL1RNERAP1MAGI3
SCHEMBL12262857 0.86 ERBB2 (0.55) ERAP2KISS1RIL23RMAGI3
SCHEMBL20626892 0.85 ERAP2 (0.51) ERAP2KISS1RIL1RNIL23R

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
CN-117402256-A Protein dimers consisting of GLP-1 and EGF (A) analogues 乐普(北京)医疗器械股份有限公司 2024-01-16 — — CN disclosed
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