SCHEMBL21111056

SCHEMBL21111056

CCCCCNC(=N)NCCCC(N)C(=O)O

nearest known ligand 0.58

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
DPP7 Q9UHL4 2/20 0.58
NOD1 Q9Y239 5/20 0.52
GNAI3 P08754 1/20 0.51
GNAO1 P09471 1/20 0.51
GNAI1 P63096 1/20 0.51
RRM1 P23921 1/20 0.50
OTC P00480 1/20 0.49
GRIK1 P39086 2/20 0.46
GRIK2 Q13002 2/20 0.46
SLC1A2 P43004 2/20 0.46
SLC1A1 P43005 2/20 0.46
DDAH1 O94760 1/20 0.44
NOS3 P29474 1/20 0.44
NOS1 P29475 1/20 0.44
NOS2 P35228 1/20 0.44
SLC1A3 P43003 1/20 0.44
EPHX1 P07099 2/20 0.43
SMN1; SMN2 Q16637 1/20 0.43

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
SCHEMBL8730134 0.95 NOD1 (0.52) DPP7NOD1GNAI3GNAO1GNAI1
SCHEMBL29551297 0.94 DPP7 (0.54) DPP7NOD1GNAI3GNAO1GNAI1
SCHEMBL1343416 0.92 DPP7 (0.53) DPP7NOD1GNAI3GNAO1GNAI1
SCHEMBL3508097 0.92 OTC (0.50) DPP7NOD1GNAI3GNAO1GNAI1
SCHEMBL1004634 0.92 OTC (0.50) DPP7NOD1GNAI3GNAO1GNAI1
Hydrochloric Acid SCHEMBL30271216 0.90 OTC (0.49) DPP7NOD1GNAI3GNAO1GNAI1
SCHEMBL21089975 0.89 OTC (0.50) DPP7NOD1OTCDDAH1NOS3
SCHEMBL12028765 0.89 OTC (0.50) DPP7NOD1OTCDDAH1NOS3
Arginine SCHEMBL14742697 0.87 DPP7 (0.54) DPP7NOD1GNAI3GNAO1GNAI1
SCHEMBL30302208 0.87 DPP7 (0.46) DPP7NOD1GNAI3GNAO1GNAI1

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-3506999-A1 OPEN-PORE MEMBRANE HAVING AN INNER SPACE-SPANNING POLYMERIC STRUCTURAL NETWORK FOR ELECTROPHORETIC MATERIAL-SELECTIVE SEPARATION AND METHODS FOR PRODUCING AND USING SAME Drei Lilien PVG GmbH & Co. KG (DE) 2019-07-10 EP claimed
EP-3506999-A1 OPEN-PORE MEMBRANE HAVING AN INNER SPACE-SPANNING POLYMERIC STRUCTURAL NETWORK FOR ELECTROPHORETIC MATERIAL-SELECTIVE SEPARATION AND METHODS FOR PRODUCING AND USING SAME Drei Lilien PVG GmbH & Co. KG (DE) 2019-07-10 EP disclosed