SCHEMBL7588339

SCHEMBL7588339

NCCCC[C@H](N)C(=O)N[C@H]([C]=O)Cc1ccc(F)c(F)c1

nearest known ligand 0.43

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
MMP2 P08253 1/20 0.43
MME P08473 1/20 0.40
CTSC P53634 4/20 0.40
TERT O14746 3/20 0.39
DPP9 Q86TI2 2/20 0.38
DPP8 Q6V1X1 1/20 0.38
DPP7 Q9UHL4 1/20 0.38
LTA4H P09960 1/20 0.37
THRB P10828 1/20 0.36
CYP1A2 P05177 1/20 0.36
CYP3A4 P08684 1/20 0.36
CTSH P09668 1/20 0.36
CYP2D6 P10635 1/20 0.36
CTSK P43235 1/20 0.36
DPP4 P27487 1/20 0.36

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 0.84 MMP2 (0.48) MMP2CTSC
SCHEMBL4672649 0.84 MMP2 (0.48) MMP2CTSC
SCHEMBL6380974 0.83 MMP2 (0.62) MMP2CTSCLTA4HCYP1A2CYP3A4
SCHEMBL22503746 0.82 MME (0.48) MMP2MME
SCHEMBL7584570 0.81 MMP2 (0.47) MMP2CTSCTERTDPP9DPP8
SCHEMBL7591254 0.78 HDAC8 (0.41) MMP2MMECTSCTERTDPP9
SCHEMBL10441228 0.77 MMP2 (0.55) MMP2CTSCLTA4HTHRBCYP1A2
SCHEMBL2183041 0.77 NPY4R (0.43) MMP2
SCHEMBL7751947 0.77 DPP7 (0.50) MMP2TERTDPP9DPP8DPP7
SCHEMBL7751944 0.77 DPP7 (0.50) MMP2TERTDPP9DPP8DPP7

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-2002100885-A2 A PENTA- OR TETRAPEPTIDE BINDING TO SOMATOSTATIN RECEPTORS AND THE USE OF THE SAME NOVASPIN BIOTECH GMBH (DE) 2002-12-19 WO disclosed