SCHEMBL9769709

SCHEMBL9769709

CC(Oc1cc(N)c(F)cc1Cl)c1ccccc1

nearest known ligand 0.48

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
RORC P51449 3/20 0.48
SCN1A P35498 5/20 0.46
SCN5A Q14524 5/20 0.46
SCN8A Q9UQD0 5/20 0.46
MET P08581 2/20 0.41
JAK2 O60674 1/20 0.41
SLC6A4 P31645 2/20 0.40
NUDT1 P36639 1/20 0.38
NOS2 P35228 2/20 0.38
POLB P06746 1/20 0.36
DHFR P00374 2/20 0.36
CYP2D6 P10635 1/20 0.36
SLC6A2 P23975 1/20 0.36
PPARG P37231 1/20 0.36
PPARA Q07869 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
SCHEMBL4678114 0.79 PPOX (0.45) RORCPOLB
SCHEMBL12173109 0.77 RORC (0.58) RORCSCN1ASCN5ASCN8ASLC6A4
SCHEMBL8879333 0.76 NPC1 (0.43) MET
SCHEMBL29278731 0.75 ALDH1A1 (0.47) CYP2D6PPARG
SCHEMBL8602961 0.75 ALDH1A1 (0.47) CYP2D6PPARG
SCHEMBL10811265 0.74 NPC1 (0.38) POLB
SCHEMBL8599131 0.74 SLC2A1 (0.39)
SCHEMBL13577011 0.74 ALOX5 (0.47) NUDT1
SCHEMBL7689433 0.73 NPC1 (0.36) MET
SCHEMBL8599124 0.73 NPC1 (0.36)

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
US-5068365-A Herbicides TOSOH CORPORATION (JP) 1991-11-26 US disclosed
EP-0326764-A2 Hexahydrophthalic anilide derivatives and herbicide compositions containing the same Tosoh Corporation (JP) 1989-08-09 EP disclosed