SCHEMBL9507822

SCHEMBL9507822

CNC(=O)n1ccc(C)n1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NOS1 P29475 1/20 0.50
PLAU P00749 2/20 0.49
ELANE P08246 2/20 0.49
SCN4A P35499 1/20 0.47
F2 P00734 1/20 0.44
KLKB1 P03952 1/20 0.44
SIRT5 Q9NXA8 1/20 0.44
KDM4E B2RXH2 4/20 0.43
GAA P10253 2/20 0.43
L3MBTL1 Q9Y468 1/20 0.42
MAPT P10636 2/20 0.41
TSHR P16473 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.37
MEN1 O00255 1/20 0.37
KMT2A Q03164 1/20 0.37
ALDH1A1 P00352 3/20 0.36
RAB9A P51151 1/20 0.36
HPGD P15428 2/20 0.36
RECQL P46063 1/20 0.36
NPSR1 Q6W5P4 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
SCHEMBL162196 0.80 SCN4A (0.47) PLAUELANESCN4AGAAMAPT
SCHEMBL12126293 0.79 NOS1 (0.46) NOS1PLAUELANEF2KLKB1
SCHEMBL348418 0.79 NOS1 (0.46) NOS1PLAUELANEF2KLKB1
SCHEMBL29356511 0.78 ALOX15 (0.44) NOS1PLAUELANEF2KLKB1
SCHEMBL3008191 0.77
SCHEMBL30171330 0.77 ASAH1 (0.44) NOS1PLAUELANEL3MBTL1
SCHEMBL12128384 0.76 PLAU (0.51) NOS1PLAUELANEF2KLKB1
SCHEMBL19687206 0.76 NOS1 (0.60) NOS1PLAUELANEF2KLKB1
SCHEMBL9503800 0.76 NOS1 (0.50) NOS1PLAUELANEF2KLKB1
SCHEMBL23583965 0.76 SCN4A (0.43) PLAUELANESCN4AF2KLKB1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0547055-A1 AGENTS FOR INCREASING BIOMASS PRODUCTION SKW STICKSTOFFWERKE PIESTERITZ GmbH (DE) 1993-06-23 EP claimed
WO-1991018509-A1 AGENTS FOR INCREASING BIOMASS PRODUCTION STICKSTOFFWERKE AG WITTENBERG-PIESTERITZ (DE) 1991-12-12 WO claimed
EP-3541805-B1 HETEROARYL-SUBSTITUTED TRIAZOLES AS APJ RECEPTOR AGONISTS AMGEN INC (US) 2020-10-14 EP disclosed
WO-2018097945-A1 HETEROARYL-SUBSTITUTED TRIAZOLES AS APJ RECEPTOR AGONISTS AMGEN INC. (US) 2018-05-31 WO disclosed
CN-104628468-A Synergist for composite/compound fertilizer, as well as preparation method and using method thereof ZHANG BIN 2015-05-20 CN disclosed
WO-2007045758-A1 6-HETEROARYLPYRIDOINDOLONE DERIVATIVES, THEIR PREPARATION AND THERAPEUTIC USE THEREOF SANOFI AVENTIS (FR) 2007-04-26 WO disclosed
EP-0547055-A1 AGENTS FOR INCREASING BIOMASS PRODUCTION SKW STICKSTOFFWERKE PIESTERITZ GmbH (DE) 1993-06-23 EP disclosed
WO-1991018509-A1 AGENTS FOR INCREASING BIOMASS PRODUCTION STICKSTOFFWERKE AG WITTENBERG-PIESTERITZ (DE) 1991-12-12 WO disclosed