SCHEMBL27644676

SCHEMBL27644676

CSCC[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](Cc1cnc[nH]1)NC(=O)CN)C(N)=O

nearest known ligand 0.63

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ REN P00797 9/20 0.63
▸ SLC15A2 Q16348 1/20 0.58
▸ GRPR P30550 1/20 0.51
▸ GHSR Q92847 1/20 0.50
▸ ERAP2 Q6P179 1/20 0.49
▸ ERAP1 Q9NZ08 1/20 0.49
▸ LNPEP Q9UIQ6 1/20 0.49

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
SCHEMBL11225559 0.88 LTA4H (0.54) —
SCHEMBL27624690 0.87 SLC15A2 (0.57) RENSLC15A2GRPRERAP2ERAP1
SCHEMBL28042757 0.85 SLC15A2 (0.70) RENSLC15A2
SCHEMBL27644660 0.85 QRFPR (0.55) —
SCHEMBL27644664 0.85 QRFPR (0.55) —
SCHEMBL18862332 0.83 REN (0.69) RENSLC15A2ERAP2ERAP1LNPEP
SCHEMBL27644678 0.83 LTA4H (0.46) GRPR
SCHEMBL30051473 0.81 LTA4H (0.64) —
SCHEMBL12374166 0.80 REN (0.54) RENSLC15A2GRPRERAP2ERAP1
SCHEMBL13563453 0.80 REN (0.72) RENGHSRERAP2ERAP1LNPEP

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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