SCHEMBL20205879

SCHEMBL20205879

CCC(=N/N=C(/C)c1ccc(F)cc1)OCc1c(C)cccc1N(N)C(=O)N(C)N

nearest known ligand 0.35

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 2/20 0.35
MEN1 O00255 1/20 0.35
TSHR P16473 1/20 0.32
NPC1 O15118 1/20 0.31
POLB P06746 1/20 0.31
RAB9A P51151 1/20 0.31
CYP1A2 P05177 1/20 0.31
KDM4E B2RXH2 1/20 0.30
LMNA P02545 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
SCHEMBL23678210 0.88 KMT2A (0.33) KMT2AMEN1TSHRNPC1POLB
SCHEMBL23678116 0.86
SCHEMBL20205513 0.84
SCHEMBL23678400 0.84 PPARG (0.35) KMT2AMEN1NPC1RAB9ALMNA
SCHEMBL23678458 0.84 PPARG (0.34) KMT2AMEN1NPC1RAB9ALMNA
SCHEMBL20205663 0.84
SCHEMBL23678455 0.84 RXFP1 (0.39) KMT2AMEN1TSHRNPC1RAB9A
SCHEMBL20205434 0.83 ADORA2A (0.31)
SCHEMBL23678294 0.83
SCHEMBL23678445 0.82 NOTUM (0.33)

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
WO-2018097318-A1 TETRAZOLINONE COMPOUNDS AND ITS USE AS PEST CONTROL AGENTS SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2018-05-31 WO disclosed