SCHEMBL8567236

SCHEMBL8567236

NCCCC[C@H](N)C(=O)N[C@@H]([C]=O)CCC(=O)O

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FOLH1 Q04609 1/20 0.47
GSR P00390 2/20 0.46
DPP8 Q6V1X1 5/20 0.45
DPP9 Q86TI2 5/20 0.45
DPP7 Q9UHL4 4/20 0.45
DPP4 P27487 2/20 0.43
GNAI3 P08754 1/20 0.41
GNAO1 P09471 1/20 0.41
GNAI1 P63096 1/20 0.41
MMP2 P08253 1/20 0.39
CYP2D6 P10635 1/20 0.39
NFKB1 P19838 1/20 0.39
BLM P54132 2/20 0.38
NPSR1 Q6W5P4 2/20 0.38
LMNA P02545 2/20 0.38
THRB P10828 2/20 0.38
KMT2A Q03164 2/20 0.38
MEN1 O00255 1/20 0.38
ALDH1A1 P00352 1/20 0.38
PLG P00747 1/20 0.38

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
SCHEMBL1888867 1.00 FOLH1 (0.47) FOLH1GSRDPP8DPP9DPP7
SCHEMBL1889778 0.94 DPP8 (0.47) FOLH1GSRDPP8DPP9DPP7
SCHEMBL1649812 0.91 FOLH1 (0.48) FOLH1GSRDPP8DPP9DPP7
SCHEMBL7751944 0.89 DPP7 (0.50) GSRDPP8DPP9DPP7DPP4
SCHEMBL7751947 0.89 DPP7 (0.50) GSRDPP8DPP9DPP7DPP4
SCHEMBL2192330 0.88 DPP8 (0.45) FOLH1GSRDPP8DPP9DPP7
SCHEMBL9142314 0.88 DPP4 (0.54) FOLH1GSRDPP8DPP9DPP4
SCHEMBL2196575 0.86 FOLH1 (0.41) FOLH1GSRDPP8DPP9DPP7
SCHEMBL2193972 0.85 FOLH1 (0.43) FOLH1DPP8DPP9DPP7DPP4
SCHEMBL2181866 0.84 TERT (0.43) FOLH1GSRDPP8DPP9DPP7

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
EP-0819135-A1 SUGAR-MODIFIED CYTOSTATICS BAYER AG (DE) 1998-01-21 EP disclosed
WO-1996031532-A1 SUGAR-MODIFIED CYTOSTATICS BAYER AKTIENGESELLSCHAFT (DE) 1996-10-10 WO disclosed