SCHEMBL20205487

SCHEMBL20205487

CC/C(=N\N=C(C)c1cnc2ccccc2n1)OCc1c(C)cccc1N(N)C(=O)N(C)N

nearest known ligand 0.36

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.36
KMT2A Q03164 2/20 0.36
ALDH1A1 P00352 3/20 0.35
NPC1 O15118 2/20 0.35
MAPT P10636 2/20 0.35
RAB9A P51151 2/20 0.35
ABCB1 P08183 1/20 0.35
HTT P42858 1/20 0.35
ABCG2 Q9UNQ0 1/20 0.35
KDM4E B2RXH2 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
CYP1A2 P05177 1/20 0.33
CYP2C9 P11712 1/20 0.33
HIF1A Q16665 1/20 0.33
HPGD P15428 1/20 0.31
ALOX15 P16050 1/20 0.31
HSD17B10 Q99714 1/20 0.31
GAA P10253 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
SCHEMBL20205486 0.85 GAA (0.34) KMT2ANPC1MAPTRAB9AHTT
SCHEMBL20205663 0.83
SCHEMBL23678258 0.83 SMN1; SMN2 (0.37) MEN1KMT2AALDH1A1NPC1MAPT
SCHEMBL20205821 0.83
SCHEMBL20205785 0.82 SMN1; SMN2 (0.36) ALDH1A1NPC1MAPTRAB9AHTT
SCHEMBL23678116 0.82
SCHEMBL23678154 0.81 TSHR (0.31)
SCHEMBL23678403 0.81 LMNA (0.31) RAB9A
SCHEMBL20205617 0.81 RAB9A (0.32) KMT2AALDH1A1NPC1RAB9ASMN1; SMN2
SCHEMBL20205513 0.80

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3544973-B1 TETRAZOLINONE COMPOUNDS AND ITS USE AS PEST CONTROL AGENTS SUMITOMO CHEMICAL CO (JP) 2021-07-28 EP disclosed
WO-2018097318-A1 TETRAZOLINONE COMPOUNDS AND ITS USE AS PEST CONTROL AGENTS SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2018-05-31 WO disclosed