SCHEMBL20195473

SCHEMBL20195473

CSc1cccc(N(C)N)c1COc1cccnc1Cl

nearest known ligand 0.34

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 2/20 0.33
CASP6 P55212 1/20 0.33
CHRNB2 P17787 3/20 0.33
CHRNA4 P43681 3/20 0.33
BDKRB2 P30411 1/20 0.32
NPC1 O15118 1/20 0.32
MAPT P10636 1/20 0.32
RAB9A P51151 1/20 0.32
SLC6A2 P23975 1/20 0.31
SLC6A4 P31645 1/20 0.31
SLC6A3 Q01959 1/20 0.31
KDM4E B2RXH2 1/20 0.30
SGMS2 Q8NHU3 1/20 0.30
TDP1 Q9NUW8 1/20 0.30
LTA4H P09960 1/20 0.30
MAPK14 Q16539 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
SCHEMBL20195414 0.83 TDP1 (0.41) L3MBTL1CHRNB2CHRNA4NPC1MAPT
SCHEMBL20195514 0.79 HTR1A (0.39) CHRNB2CHRNA4SLC6A2SLC6A4SLC6A3
SCHEMBL18871645 0.75 MAPT (0.33) L3MBTL1BDKRB2MAPTSLC6A2SLC6A4
SCHEMBL18871226 0.74 MAPT (0.35) L3MBTL1NPC1MAPTRAB9ASLC6A2
SCHEMBL18870767 0.73 SLC22A12 (0.32) L3MBTL1NPC1MAPTRAB9ASLC6A2
SCHEMBL20686619 0.73 MRGPRX4 (0.42) MAPTSLC6A2SLC6A4SLC6A3TDP1
SCHEMBL22563873 0.70 SIGMAR1 (0.39)
SCHEMBL20195533 0.70 P2RX7 (0.38) L3MBTL1CASP6NPC1MAPTRAB9A
SCHEMBL18871256 0.70 PTGDR2 (0.35)
SCHEMBL27736337 0.69 SMN1; SMN2 (0.38) CASP6NPC1MAPTRAB9ASLC6A2

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-3029035-B1 TETRAZOLINONE COMPOUND, AND USE THEREOF SUMITOMO CHEMICAL CO (JP) 2018-05-30 EP disclosed