SCHEMBL11376353

SCHEMBL11376353

Cc1cc(-n2c(=S)n3n(c2=S)CCCC3)ccc1Cl

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 1/20 0.37
RAB9A P51151 1/20 0.37
CTSB P07858 1/20 0.36
TDP1 Q9NUW8 1/20 0.36
ALDH1A1 P00352 3/20 0.36
MAPT P10636 1/20 0.36
GFER P55789 1/20 0.36
LMNA P02545 1/20 0.35
MEN1 O00255 1/20 0.35
KMT2A Q03164 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
CYP19A1 P11511 1/20 0.35
POLB P06746 1/20 0.35
CCR1 P32246 1/20 0.34
CCR2 P41597 1/20 0.34
HPGD P15428 1/20 0.34
MYC P01106 1/20 0.33
NR4A1 P22736 1/20 0.33
HTT P42858 1/20 0.33
KCNH2 Q12809 1/20 0.33

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
SCHEMBL11363847 0.91 ALDH1A1 (0.44) NPC1RAB9ACTSBTDP1ALDH1A1
SCHEMBL11363388 0.85 ADRB1 (0.43) ALDH1A1MAPTLMNAMEN1KMT2A
SCHEMBL11363386 0.85 ADRB1 (0.43) ALDH1A1MAPTLMNAMEN1KMT2A
SCHEMBL11366159 0.82 ALDH1A1 (0.54) NPC1RAB9ACTSBTDP1ALDH1A1
SCHEMBL11366859 0.81 MAPT (0.44) NPC1RAB9ATDP1ALDH1A1MAPT
SCHEMBL11361250 0.78 ALDH1A1 (0.43) TDP1ALDH1A1MAPTLMNAMEN1
SCHEMBL11369651 0.76 ALDH1A1 (0.47) ALDH1A1MAPTLMNAMEN1KMT2A
SCHEMBL11358963 0.75 SMN1; SMN2 (0.41) ALDH1A1MAPTGFERLMNAMEN1
SCHEMBL16727172 0.75 MAPT (0.53) NPC1RAB9ATDP1ALDH1A1MAPT
SCHEMBL11372936 0.75 TDP1 (0.42) NPC1RAB9ATDP1ALDH1A1MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4249934-A 1,2-Alkylene-4-substituted urazole herbicides MITSUBISHI CHEMICAL INDUSTRIES, LIMITED (JP) 1981-02-10 US disclosed