SCHEMBL14640487

SCHEMBL14640487

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

nearest known ligand 0.61

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
GSR P00390 1/20 0.61
DPP7 Q9UHL4 11/20 0.49
DPP8 Q6V1X1 6/20 0.49
DPP9 Q86TI2 5/20 0.49
GNAI3 P08754 1/20 0.47
GNAO1 P09471 1/20 0.47
GNAI1 P63096 1/20 0.47
DPP4 P27487 5/20 0.46
MMP2 P08253 1/20 0.44
RNPEP Q9H4A4 1/20 0.43
CHRM2 P08172 1/20 0.43
CHRM4 P08173 1/20 0.43
CHRM1 P11229 1/20 0.43
FAP Q12884 1/20 0.41
CYP2D6 P10635 1/20 0.41
NFKB1 P19838 1/20 0.41

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
SCHEMBL9840679 0.98 GSR (0.59) GSRDPP7DPP8DPP9GNAI3
SCHEMBL17029472 0.89 GSR (0.59) GSRDPP7DPP8DPP9GNAI3
SCHEMBL22807654 0.85 GSR (0.55) GSRDPP7DPP8DPP9GNAI3
SCHEMBL15184957 0.85 GSR (0.55) GSRDPP7DPP8DPP9GNAI3
SCHEMBL14117682 0.85 GNAI3 (0.56) GSRDPP7DPP8DPP9GNAI3
SCHEMBL17613289 0.84 GSR (0.64) GSRDPP7DPP8DPP9GNAI3
SCHEMBL18499975 0.84 GSR (0.64) GSRDPP7DPP8DPP9GNAI3
SCHEMBL19186295 0.84 CHRM2 (0.54) GSRDPP7DPP8DPP9GNAI3
SCHEMBL14154835 0.84 GNAI3 (0.58) GSRDPP7DPP8DPP9GNAI3
SCHEMBL126835 0.84 GSR (0.53) GSRDPP7DPP8DPP9GNAI3

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
US-20070015260-A1 Synthesis of synthons for the manufacture of bioactive compounds DIVERSA CORPORATION 2007-01-18 US disclosed