SCHEMBL27624718

SCHEMBL27624718

CSCC[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc1cnc[nH]1)NC(=O)[C@@H](C)N)C(N)=O

nearest known ligand 0.51

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ REN P00797 8/20 0.51
▸ ERAP2 Q6P179 1/20 0.49
▸ ERAP1 Q9NZ08 1/20 0.49
▸ LNPEP Q9UIQ6 1/20 0.49
▸ GRPR P30550 4/20 0.46
▸ SLC15A2 Q16348 1/20 0.45
▸ SIRT2 Q8IXJ6 4/20 0.44
▸ SIRT1 Q96EB6 4/20 0.44
▸ SIRT3 Q9NTG7 4/20 0.44

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
SCHEMBL18402423 0.92 REN (0.60) RENERAP2ERAP1LNPEPGRPR
SCHEMBL12374166 0.90 REN (0.54) RENERAP2ERAP1LNPEPGRPR
SCHEMBL27624690 0.90 SLC15A2 (0.57) RENERAP2ERAP1LNPEPGRPR
SCHEMBL16350346 0.90 REN (0.49) RENERAP2ERAP1LNPEPGRPR
SCHEMBL12972224 0.90 REN (0.49) RENERAP2ERAP1LNPEPGRPR
SCHEMBL12232397 0.89 REN (0.48) RENERAP2ERAP1LNPEPGRPR
SCHEMBL27644992 0.87 GRPR (0.53) RENGRPR
SCHEMBL16317506 0.86 REN (0.51) RENGRPR
SCHEMBL13781414 0.84 GRPR (0.57) GRPR
SCHEMBL18862042 0.83 REN (0.56) RENERAP2ERAP1LNPEPSLC15A2

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-1897980-A Improved gastrin releasing peptide compounds BRACCO IMAGING SPA (IT) 2007-01-17 — — CN disclosed
CN-1738650-A Improved gastrin releasing peptide compounds BRACCO IMAGING SPA (IT) 2006-02-22 — — CN disclosed
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