SCHEMBL26126284

SCHEMBL26126284

NCCCC(=O)N[C@H](Cc1c[nH]cn1)C(=O)O

nearest known ligand 0.44

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ ITGB3 P05106 8/20 0.44
▸ ITGA2B P08514 8/20 0.44
▸ SLC15A2 Q16348 1/20 0.39
▸ SLC6A5 Q9Y345 2/20 0.39
▸ CPB2 Q96IY4 4/20 0.37
▸ PIN1 Q13526 1/20 0.37
▸ EPHX2 P34913 1/20 0.36
▸ CPB1 P15086 1/20 0.36
▸ PPARG P37231 1/20 0.35

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
SCHEMBL10937318 1.00 ITGB3 (0.44) ITGB3ITGA2BSLC15A2SLC6A5CPB2
SCHEMBL541261 1.00 ITGB3 (0.44) ITGB3ITGA2BSLC15A2SLC6A5CPB2
SCHEMBL7893552 0.97 ITGB3 (0.47) ITGB3ITGA2BSLC15A2SLC6A5CPB2
SCHEMBL7257726 0.96 ITGB3 (0.48) ITGB3ITGA2BSLC15A2SLC6A5CPB2
Methoxymethane SCHEMBL2940968 0.95 ITGB3 (0.46) ITGB3ITGA2BSLC15A2SLC6A5CPB2
SCHEMBL7887537 0.95 ITGB3 (0.50) ITGB3ITGA2BSLC15A2SLC6A5
SCHEMBL4653518 0.95 ITGB3 (0.50) ITGB3ITGA2BSLC15A2SLC6A5
SCHEMBL8630043 0.95 ITGB3 (0.50) ITGB3ITGA2BSLC15A2SLC6A5
Carnosine SCHEMBL33768 0.92 ITGB3 (0.41) ITGB3ITGA2BSLC15A2SLC6A5CPB2
Carnosine SCHEMBL3904964 0.92 ITGB3 (0.41) ITGB3ITGA2BSLC15A2SLC6A5CPB2

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
WO-2023188173-A1 AGENT FOR INCREASING INTRACEREBRAL GABA 日本ハム株式会社 2023-10-05 — — WO disclosed
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