SCHEMBL7980406

SCHEMBL7980406

CCCN(C(=O)Cl)C1CCOC1

nearest known ligand 0.38

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
PIK3CD O00329 1/20 0.38
NPC1 O15118 2/20 0.34
RAB9A P51151 2/20 0.34
MEN1 O00255 1/20 0.34
KMT2A Q03164 1/20 0.34
PYGL P06737 1/20 0.33
SLC6A2 P23975 1/20 0.30
SLC6A4 P31645 1/20 0.30
SLC6A3 Q01959 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
SCHEMBL7992320 0.90 PIK3CD (0.47) PIK3CDNPC1RAB9APYGLSLC6A2
SCHEMBL7786917 0.80 SLC6A4 (0.36) PYGLSLC6A2SLC6A4SLC6A3
SCHEMBL8034863 0.77 ADH1A (0.46) MEN1KMT2APYGLSLC6A4
SCHEMBL7992646 0.75 PIK3CD (0.50) PIK3CDNPC1RAB9AMEN1KMT2A
SCHEMBL8903152 0.75 ADH1A (0.47) NPC1RAB9AMEN1KMT2APYGL
SCHEMBL8041770 0.75 ADH1A (0.47) NPC1RAB9AMEN1KMT2APYGL
SCHEMBL8977190 0.74 SLC6A4 (0.33) PYGLSLC6A2SLC6A4SLC6A3
SCHEMBL7994900 0.72 SLC6A4 (0.33) SLC6A2SLC6A4SLC6A3
SCHEMBL16264298 0.72 DRD3 (0.38) PIK3CD
SCHEMBL8977205 0.71 CA12 (0.37) MEN1KMT2APYGLSLC6A2SLC6A4

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