SCHEMBL9953904

SCHEMBL9953904

Cn1ccnc1-c1c(F)cc(Cl)cc1C(F)(F)F

nearest known ligand 0.39

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
HSD11B1 P28845 4/20 0.39
LRRK2 Q5S007 1/20 0.37
RORC P51449 1/20 0.36
KDM4C Q9H3R0 1/20 0.34
MCL1 Q07820 1/20 0.33
OPRK1 P41145 3/20 0.32
TGFBR1 P36897 1/20 0.32
TRPM5 Q9NZQ8 1/20 0.31
KCNH2 Q12809 1/20 0.31
IL1B P01584 1/20 0.31
DPP4 P27487 1/20 0.31

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
SCHEMBL9952924 0.84 HTT (0.33) LRRK2RORCOPRK1DPP4
SCHEMBL9952956 0.79 KMT2A (0.36) HSD11B1LRRK2KDM4COPRK1TRPM5
SCHEMBL9930969 0.71 COMT (0.54) RORCKDM4CKCNH2
SCHEMBL9951982 0.70 NPC1 (0.32) LRRK2OPRK1
SCHEMBL9952037 0.69 OPRK1 (0.32) OPRK1
SCHEMBL12320160 0.69 SMN1; SMN2 (0.52) HSD11B1LRRK2
SCHEMBL14960646 0.68 TGFBR1 (0.50) LRRK2TGFBR1KCNH2
SCHEMBL27759199 0.67 LPO (0.44)
SCHEMBL24575964 0.67 MYC (0.40) LRRK2DPP4
SCHEMBL27589731 0.67 BRD4 (0.42)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-103261170-B Fused heterocyclic compounds and their use for pest control 住友化学株式会社 2016-08-24 CN disclosed
EP-2655337-A1 FUSED HETEROCYCLIC COMPOUND AND USE FOR PEST CONTROL THEREOF Sumitomo Chemical Company Limited (JP) 2013-10-30 EP disclosed
CN-103261170-A Fused heterocyclic compounds and their use for pest control SUMITOMO CHEMICAL CO 2013-08-21 CN disclosed
WO-2012086848-A1 FUSED HETEROCYCLIC COMPOUND AND USE FOR PEST CONTROL THEREOF SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2012-06-28 WO disclosed