SCHEMBL11567924

SCHEMBL11567924

CCCCSCc1[c]cccc1

nearest known ligand 0.38

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.38
TDP1 Q9NUW8 1/20 0.38
ALDH1A1 P00352 2/20 0.36
NPSR1 Q6W5P4 2/20 0.36
NPC1 O15118 1/20 0.34
RAB9A P51151 1/20 0.34
LMNA P02545 1/20 0.33
HTT P42858 1/20 0.33
RECQL P46063 1/20 0.33
CTSB P07858 1/20 0.31
S100A4 P26447 1/20 0.31
SOAT1 P35610 1/20 0.31
PTGS2 P35354 1/20 0.31
MAPT P10636 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
SCHEMBL7990820 0.95 KDM4E (0.35) KDM4ETDP1ALDH1A1NPSR1SOAT1
SCHEMBL11567389 0.89
SCHEMBL1986545 0.81 KDM4E (0.33) KDM4EALDH1A1
SCHEMBL7625041 0.80 CYP1A2 (0.32)
SCHEMBL7771860 0.78 TDP1 (0.33) KDM4ETDP1ALDH1A1NPSR1NPC1
SCHEMBL22715 0.77 MAP2K7 (0.34) ALDH1A1
SCHEMBL17929 0.75 LTA4H (0.35)
SCHEMBL28079021 0.73 LTA4H (0.34)
SCHEMBL28252911 0.73 LTA4H (0.34)
SCHEMBL28193154 0.73 LTA4H (0.34)

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
EP-0000895-A1 Aryl-N-alkylcarbamates, method for their preparation and their use as insecticides BAYER AG (DE) 1979-03-07 EP disclosed