SCHEMBL9952956

SCHEMBL9952956

CCSc1cc(Cl)cc(C(F)(F)F)c1-c1nccn1C

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 3/20 0.36
LMNA P02545 1/20 0.34
CCR2 P41597 1/20 0.34
LRRK2 Q5S007 1/20 0.34
MEN1 O00255 1/20 0.33
ALOX15 P16050 1/20 0.33
ALOX12 P18054 1/20 0.33
TRPM5 Q9NZQ8 1/20 0.32
IL1B P01584 1/20 0.32
NPC1 O15118 2/20 0.32
RAB9A P51151 2/20 0.32
TP53 P04637 1/20 0.32
OPRK1 P41145 3/20 0.32
HSD11B1 P28845 2/20 0.31
KDM4C Q9H3R0 1/20 0.31
BRD4 O60885 2/20 0.31
ALDH1A1 P00352 2/20 0.30
POLB P06746 1/20 0.30
SMN1; SMN2 Q16637 1/20 0.30
THRB P10828 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
SCHEMBL9951982 0.88 NPC1 (0.32) LRRK2NPC1RAB9AOPRK1ALDH1A1
SCHEMBL9952738 0.86 RAB9A (0.33) KMT2AMEN1ALOX12NPC1RAB9A
SCHEMBL9953904 0.79 HSD11B1 (0.39) LRRK2TRPM5IL1BOPRK1HSD11B1
SCHEMBL9953108 0.77 KMT2A (0.36) KMT2ACCR2LRRK2MEN1ALOX15
SCHEMBL21895290 0.74 KMT2A (0.39) KMT2ALMNANPC1RAB9ATP53
SCHEMBL30772990 0.74 KMT2A (0.39) KMT2ALMNANPC1RAB9ATP53
SCHEMBL9952318 0.72 ALDH1A1 (0.35) KMT2ALMNAMEN1ALOX15ALOX12
SCHEMBL9952936 0.72 NPC1 (0.35) NPC1RAB9ATP53OPRK1HSD11B1
SCHEMBL29755406 0.71 NPC1 (0.41) KMT2AMEN1NPC1RAB9AHSD11B1
SCHEMBL3721717 0.71 NPC1 (0.37) LRRK2NPC1RAB9AOPRK1BRD4

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
EP-2655337-A1 FUSED HETEROCYCLIC COMPOUND AND USE FOR PEST CONTROL THEREOF Sumitomo Chemical Company Limited (JP) 2013-10-30 EP disclosed
WO-2012086848-A1 FUSED HETEROCYCLIC COMPOUND AND USE FOR PEST CONTROL THEREOF SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2012-06-28 WO disclosed