SCHEMBL28755697

SCHEMBL28755697

Nc1ccc(C(=O)O)c(C(=O)OCC2c3ccccc3-c3ccccc32)n1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FABP5 Q01469 3/20 0.45
FABP7 O15540 2/20 0.45
KMT2A Q03164 2/20 0.43
GABRP O00591 3/20 0.39
GABRD O14764 3/20 0.39
GABRA1 P14867 3/20 0.39
GABRB1 P18505 3/20 0.39
GABRG2 P18507 3/20 0.39
GABRB3 P28472 3/20 0.39
GABRA5 P31644 3/20 0.39
GABRA3 P34903 3/20 0.39
GABRA2 P47869 3/20 0.39
GABRB2 P47870 3/20 0.39
GABRA4 P48169 3/20 0.39
GABRE P78334 3/20 0.39
GABRA6 Q16445 3/20 0.39
GABRG1 Q8N1C3 3/20 0.39
GABRG3 Q99928 3/20 0.39
GABRQ Q9UN88 3/20 0.39
CA1 P00915 1/20 0.39

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
SCHEMBL346078 0.85 KMT2A (0.44) FABP5FABP7KMT2ACA1CA2
SCHEMBL1250338 0.78 FABP5 (0.47) FABP5FABP7KMT2ACA1CA2
SCHEMBL3195566 0.78 FABP5 (0.47) FABP5FABP7KMT2ACA1CA2
SCHEMBL3220033 0.77 FABP5 (0.48) FABP5FABP7KMT2ACA1CA2
SCHEMBL6346119 0.77 FABP5 (0.48) FABP5FABP7KMT2ACA1CA2
SCHEMBL30662743 0.77 FABP5 (0.49) FABP5FABP7KMT2ACA1CA2
SCHEMBL1157567 0.77 FABP5 (0.49) FABP5FABP7KMT2ACA1CA2
SCHEMBL3209504 0.77 FABP5 (0.46) FABP5FABP7KMT2ACA1CA2
SCHEMBL29197926 0.77 FABP5 (0.46) FABP5FABP7KMT2ACA1CA2
SCHEMBL3212375 0.77 FABP5 (0.46) FABP5FABP7KMT2ACA1CA2

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-102167728-B Improved gastrin releasing peptide compounds BRACCO IMAGING SPA 2013-05-29 CN disclosed
CN-102167728-A Improved gastrin releasing peptide compounds BRACCO IMAGING SPA 2011-08-31 CN disclosed
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