SCHEMBL4672649

SCHEMBL4672649

NCCCC[C@H](N)C(=O)N[C@H]([C]=O)Cc1ccc(O)cc1

nearest known ligand 0.48

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
MMP2 P08253 1/20 0.48
LNPEP Q9UIQ6 2/20 0.45
ERAP2 Q6P179 1/20 0.45
CTSC P53634 1/20 0.43
CHRND Q07001 5/20 0.42
CHRNA1 P02708 1/20 0.42
CHRNG P07510 1/20 0.42
CHRNB1 P11230 1/20 0.42
SLC7A5 Q01650 1/20 0.42

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
SCHEMBL4672644 1.00 MMP2 (0.48) MMP2LNPEPERAP2CTSCCHRND
SCHEMBL2183041 0.91 NPY4R (0.43) MMP2LNPEPERAP2CHRND
SCHEMBL6380974 0.89 MMP2 (0.62) MMP2LNPEPERAP2CTSC
SCHEMBL890405 0.85 CTSC (0.57) MMP2LNPEPERAP2CTSCSLC7A5
SCHEMBL890404 0.85 CTSC (0.57) MMP2LNPEPERAP2CTSCSLC7A5
SCHEMBL7588339 0.84 MMP2 (0.43) MMP2CTSC
SCHEMBL2183598 0.84 NAALAD2 (0.49) ERAP2CTSCSLC7A5
SCHEMBL2184229 0.83 NPY4R (0.60)
SCHEMBL516225 0.83 CTSC (0.48) MMP2CTSCSLC7A5
SCHEMBL27468879 0.83 CTSC (0.48) MMP2CTSCSLC7A5

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2023175531-A1 PROTEIN HYDROLYSATES OF AZUKI BEANS AND COSMETIC USES THEREOF LUBRIZOL ADVANCED MATERIALS, INC. (US) 2023-09-21 WO disclosed
EP-1996013-A2 METHODS AND COMPOSITIONS FOR ORGAN AND TISSUE FUNCTIONALITY Dask Technologies, LLC (US) 2008-12-03 EP disclosed
EP-1940424-A2 COMPOSITIONS AND METHODS FOR THE AUGMENTATION AND REPAIR OF DEFECTS IN TISSUE Dask Technologies, LLC (US) 2008-07-09 EP disclosed
WO-2007035843-A2 METHODS AND COMPOSITIONS FOR ORGAN AND TISSUE FUNCTIONALITY DASK TECHNOLOGIES, LLC (US) 2007-03-29 WO disclosed
WO-2007035363-A2 COMPOSITIONS AND METHODS FOR THE AUGMENTATION AND REPAIR OF DEFECTS IN TISSUE DASK TECHNOLOGIES, LLC (US) 2007-03-29 WO disclosed
US-20070065415-A1 Compositions and methods for the augmentation and repair of defects in tissue DASK TECHNOLOGIES, LLC 2007-03-22 US disclosed