SCHEMBL3396685

SCHEMBL3396685

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nearest known ligand 0.41

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
NPSR1 Q6W5P4 1/20 0.41
MME P08473 3/20 0.40
PDCD1LG2 Q9BQ51 1/20 0.37
CD274 Q9NZQ7 1/20 0.37
CA2 P00918 2/20 0.36
CTSC P53634 1/20 0.36
CA1 P00915 1/20 0.36
SDCBP O00560 1/20 0.35
SDC2 P34741 1/20 0.35
ALDH1A1 P00352 1/20 0.35
CTSD P07339 1/20 0.34

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
SCHEMBL30353283 1.00 NPSR1 (0.41) NPSR1MMEPDCD1LG2CD274CA2
SCHEMBL3396676 1.00 NPSR1 (0.41) NPSR1MMEPDCD1LG2CD274CA2
SCHEMBL31064974 0.93 NPSR1 (0.44) NPSR1MMECTSCSDCBPSDC2
SCHEMBL30122865 0.93 MME (0.42) NPSR1MMEPDCD1LG2CD274CA2
SCHEMBL29380611 0.91 NPSR1 (0.47) NPSR1MMECTSCSDCBPSDC2
SCHEMBL11106438 0.89 CA2 (0.41) NPSR1MMEPDCD1LG2CD274CA2
SCHEMBL30053244 0.89 CA2 (0.41) NPSR1MMEPDCD1LG2CD274CA2
SCHEMBL6292107 0.89 CA2 (0.41) NPSR1MMEPDCD1LG2CD274CA2
SCHEMBL31174306 0.89 CA2 (0.41) NPSR1MMEPDCD1LG2CD274CA2
SCHEMBL6292106 0.89 CA2 (0.41) NPSR1MMEPDCD1LG2CD274CA2

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2248821-B1 SUBSTRATE FOR ASSAYING -GLUCAN AND/OR ENDOTOXIN AND ASSAY METHOD WAKO PURE CHEM IND LTD (JP) 2015-01-28 EP disclosed
US-8546072-B2 Substrate for assaying β-glucan and/or endotoxin and assay method WAKO PURE CHEMICAL INDUSTRIES, LTD. (JP) 2013-10-01 US disclosed
US-20100330700-A1 SUBSTRATE FOR ASSAYING BETA-GLUCAN AND/OR ENDOTOXIN AND ASSAY METHOD WAKO PURE CHEMICAL INDUSTRIES, LTD. (JP) 2010-12-30 US disclosed
EP-2248821-A1 SUBSTRATE FOR ASSAYING -GLUCAN AND/OR ENDOTOXIN AND ASSAY METHOD Wako Pure Chemical Industries, Ltd. (JP) 2010-11-10 EP disclosed