SCHEMBL30565716

SCHEMBL30565716

CN(C)CCNC(=O)[C@@H](N)CCCNC(=N)N

nearest known ligand 0.50

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
DPP7 Q9UHL4 2/20 0.50
GNAI3 P08754 1/20 0.44
GNAO1 P09471 1/20 0.44
GNAI1 P63096 1/20 0.44
RRM1 P23921 1/20 0.43
NOS1 P29475 2/20 0.41
NOS3 P29474 1/20 0.41
NOS2 P35228 1/20 0.41
NPY4R P50391 8/20 0.39
NPY1R P25929 5/20 0.39
NPY2R P49146 4/20 0.39
NPY5R Q15761 4/20 0.39
NOD1 Q9Y239 1/20 0.36
DNM1 Q05193 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
SCHEMBL7448599 0.88 DPP7 (0.49) DPP7GNAI3GNAO1GNAI1RRM1
SCHEMBL23626315 0.86 DPP7 (0.61) DPP7GNAI3GNAO1GNAI1RRM1
SCHEMBL23610947 0.86 DPP7 (0.61) DPP7GNAI3GNAO1GNAI1RRM1
SCHEMBL16572294 0.84 DPP7 (0.53) DPP7GNAI3GNAO1GNAI1RRM1
SCHEMBL19820058 0.84 DPP7 (0.53) DPP7GNAI3GNAO1GNAI1RRM1
SCHEMBL19371883 0.83 DPP7 (0.63) DPP7GNAI3GNAO1GNAI1RRM1
SCHEMBL7324660 0.83 DPP7 (0.68) DPP7GNAI3GNAO1GNAI1RRM1
SCHEMBL7324651 0.83 DPP7 (0.68) DPP7GNAI3GNAO1GNAI1RRM1
SCHEMBL24712487 0.82 DPP7 (0.57) DPP7GNAI3GNAO1GNAI1RRM1
SCHEMBL27114206 0.82 DPP7 (0.76) DPP7GNAI3GNAO1GNAI1RRM1

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
CN-116685356-A Lipid nanoparticle compositions containing monoester cationic lipids 默沙东有限责任公司 2023-09-01 CN disclosed