SCHEMBL7992320

SCHEMBL7992320

CCCN(C(=O)Cl)C1CCOCC1

nearest known ligand 0.47

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
PIK3CD O00329 2/20 0.47
SLC6A4 P31645 2/20 0.33
HSD11B1 P28845 1/20 0.33
KCNH2 Q12809 1/20 0.33
PTGS1 P23219 1/20 0.32
PTGS2 P35354 1/20 0.32
SLC6A2 P23975 1/20 0.32
SLC6A3 Q01959 1/20 0.32
ADH1A P07327 2/20 0.31
ADH1C P00326 1/20 0.31
PYGL P06737 1/20 0.31
NPC1 O15118 1/20 0.30
RAB9A P51151 1/20 0.30

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
SCHEMBL7980406 0.90 PIK3CD (0.38) PIK3CDSLC6A4SLC6A2SLC6A3PYGL
SCHEMBL7786917 0.87 SLC6A4 (0.36) SLC6A4KCNH2PTGS1PTGS2SLC6A2
SCHEMBL7992646 0.85 PIK3CD (0.50) PIK3CDSLC6A4HSD11B1SLC6A2NPC1
SCHEMBL8034863 0.83 ADH1A (0.46) SLC6A4HSD11B1KCNH2ADH1AADH1C
SCHEMBL8903152 0.81 ADH1A (0.47) HSD11B1ADH1AADH1CPYGLNPC1
SCHEMBL8041770 0.81 ADH1A (0.47) HSD11B1ADH1AADH1CPYGLNPC1
SCHEMBL8977190 0.80 SLC6A4 (0.33) SLC6A4KCNH2PTGS1PTGS2SLC6A2
SCHEMBL7994900 0.79 SLC6A4 (0.33) SLC6A4KCNH2SLC6A2SLC6A3ADH1A
SCHEMBL5987793 0.77 L3MBTL1 (0.43) PIK3CDSLC6A4KCNH2PTGS1PTGS2
SCHEMBL8602631 0.76 L3MBTL1 (0.44) HSD11B1ADH1AADH1CPYGL

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6277790-B1 APPLYING PLANTS, SEEDS, SOILS OR ENVIRONMENT BASF AKTIENGESELLSCHAFT (DE) 2001-08-21 US disclosed
EP-1003741-A1 SUBSTITUTED HERBICIDE TETRAZOLINONECARBOXYLIC ACID AMIDES BASF AKTIENGESELLSCHAFT (DE) 2000-05-31 EP disclosed
WO-1999007702-A1 SUBSTITUTED HERBICIDE TETRAZOLINONECARBOXYLIC ACID AMIDES BASF AKTIENGESELLSCHAFT (DE) 1999-02-18 WO disclosed