SCHEMBL15975676

SCHEMBL15975676

[2H]C([2H])(CSC)C(=O)N(C)c1cn(-c2cccnc2)nc1Cl

nearest known ligand 0.35

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.35
NPC1 O15118 1/20 0.35
RAB9A P51151 1/20 0.35
FAAH O00519 1/20 0.33
KCNH2 Q12809 1/20 0.33
DGAT1 O75907 1/20 0.33
MAPK1 P28482 1/20 0.32
MAT2A P31153 1/20 0.32
GAA P10253 1/20 0.31
HTT P42858 1/20 0.30
L3MBTL1 Q9Y468 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
SCHEMBL18622360 0.90 NPC1 (0.38) ALDH1A1NPC1RAB9ADGAT1MAPK1
SCHEMBL4967836 0.90 FAAH (0.36) ALDH1A1NPC1RAB9AFAAHKCNH2
SCHEMBL2689967 0.88 ALDH1A1 (0.36) ALDH1A1NPC1RAB9AFAAHKCNH2
SCHEMBL2691588 0.87 ALDH1A1 (0.39) ALDH1A1NPC1RAB9AFAAHKCNH2
SCHEMBL15975678 0.85 FAAH (0.35) ALDH1A1NPC1RAB9AFAAHKCNH2
SCHEMBL14904701 0.84 ALDH1A1 (0.36) ALDH1A1NPC1RAB9AFAAHKCNH2
SCHEMBL15346518 0.84 NPC1 (0.39) ALDH1A1NPC1RAB9ADGAT1MAPK1
SCHEMBL16653422 0.82 NPC1 (0.38) ALDH1A1NPC1RAB9ADGAT1MAPK1
SCHEMBL15346726 0.82 NPC1 (0.38) ALDH1A1NPC1RAB9AFAAHKCNH2
SCHEMBL15356826 0.82 ALDH1A1 (0.35) ALDH1A1NPC1RAB9AFAAHKCNH2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9708288-B2 Pesticidal compositions and processes related thereto DOW AGROSCIENCES LLC (US) 2017-07-18 US disclosed
US-9655365-B2 Pesticidal compositions and processes related thereto DOW AGROSCIENCES LLC (US) 2017-05-23 US disclosed
US-9422278-B2 Pesticidal compositions and processes related thereto DOW AGROSCIENCES LLC (US) 2016-08-23 US disclosed
US-9282739-B2 Pesticidal compositions and processes related thereto DOW AGROSCIENCES LLC (US) 2016-03-15 US disclosed
US-8937083-B2 Pesticidal compositions and processes related thereto DowAgroSciences, LLC (US) 2015-01-20 US disclosed
US-8901153-B2 Pesticidal compositions and processes related thereto DOW AGROSCIENCES, LLC. (US) 2014-12-02 US disclosed
US-8815271-B2 Pesticidal compositions and processes related thereto DOW AGROSCIENCES, LLC. (US) 2014-08-26 US disclosed