SCHEMBL22745804

SCHEMBL22745804

COC(=O)c1cc(-n2c(=O)cc(C)n(C)c2=O)c(F)cc1Cl

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 4/20 0.36
CYP1A2 P05177 3/20 0.36
KMT2A Q03164 3/20 0.36
CYP2C9 P11712 2/20 0.36
LMNA P02545 2/20 0.36
ALDH1A1 P00352 2/20 0.36
HTT P42858 1/20 0.36
GAA P10253 2/20 0.36
MYC P01106 2/20 0.35
BAZ2B Q9UIF8 1/20 0.34
BAZ2A Q9UIF9 1/20 0.34
HPGD P15428 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
GUSB P08236 1/20 0.34
ALOX15 P16050 1/20 0.34
HSD17B10 Q99714 1/20 0.34
NPSR1 Q6W5P4 1/20 0.33
CYP2C19 P33261 1/20 0.33
KDM4E B2RXH2 1/20 0.33
GABRA1 P14867 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
SCHEMBL9468954 0.87 MAPT (0.35) MAPTCYP1A2KMT2ACYP2C9LMNA
SCHEMBL9350650 0.87 GAA (0.33) MAPTCYP1A2KMT2ACYP2C9LMNA
SCHEMBL9567022 0.86 TSHR (0.35) MAPTCYP1A2KMT2ACYP2C9ALDH1A1
SCHEMBL9350427 0.86 NOTUM (0.40) MAPTCYP1A2KMT2ACYP2C9ALDH1A1
SCHEMBL4070975 0.86 GAA (0.39) MAPTCYP1A2KMT2ALMNAALDH1A1
SCHEMBL9499007 0.86 CYP1A2 (0.35) MAPTCYP1A2KMT2ACYP2C9LMNA
SCHEMBL30704867 0.85 GAA (0.36) MAPTLMNAALDH1A1HTTGAA
SCHEMBL9523542 0.85 MAPT (0.35) MAPTCYP1A2KMT2ALMNAALDH1A1
SCHEMBL27559360 0.85 GAA (0.36) MAPTLMNAALDH1A1HTTGAA
SCHEMBL7547124 0.85 CYP1A2 (0.33) MAPTCYP1A2KMT2ACYP2C9GAA

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-2020237823-A1 ARYLURACIL COMPOUND AND PREPARATION METHOD THEREFOR, AND PESTICIDE COMPOSITION 深圳大学 2020-12-03 WO disclosed