SCHEMBL5311615

SCHEMBL5311615

COCN(C(=O)NC(=O)c1c(F)cccc1F)c1ccc(C(F)(F)F)cc1F

nearest known ligand 0.44

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
TRPA1 O75762 3/20 0.44
CYP1A2 P05177 1/20 0.41
KDM4E B2RXH2 2/20 0.40
HPGD P15428 1/20 0.40
IL2 P60568 2/20 0.40
TLR7 Q9NYK1 5/20 0.38
TLR8 Q9NR97 4/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
RAB9A P51151 1/20 0.36
HTT P42858 2/20 0.36
GAA P10253 1/20 0.36
NPSR1 Q6W5P4 1/20 0.35
TP53 P04637 1/20 0.35
P2RX1 P51575 1/20 0.35
P2RX7 Q99572 1/20 0.35
KMT2A Q03164 1/20 0.35

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
SCHEMBL5314994 0.86 TLR8 (0.44) KDM4ETLR7TLR8KMT2A
SCHEMBL5314610 0.84 POLB (0.40) CYP1A2HPGDRAB9AGAAKMT2A
SCHEMBL5312106 0.84 TRPA1 (0.35) TRPA1CYP1A2TLR7TLR8RAB9A
SCHEMBL5316118 0.83 KMT2A (0.37) TRPA1CYP1A2RAB9AKMT2A
SCHEMBL5313998 0.83 RAB9A (0.36) TRPA1CYP1A2KDM4EHPGDSMN1; SMN2
SCHEMBL5318477 0.83 MAPT (0.39) TRPA1KDM4ETLR7TLR8SMN1; SMN2
SCHEMBL5314713 0.83 TRPA1 (0.34) TRPA1CYP1A2RAB9AKMT2A
SCHEMBL5311213 0.83 RAB9A (0.35) TRPA1CYP1A2SMN1; SMN2RAB9AGAA
SCHEMBL4908707 0.82 IL2 (0.44) TRPA1CYP1A2IL2TLR7TLR8
SCHEMBL5312164 0.81 TRPA1 (0.33) TRPA1CYP1A2RAB9AKMT2A

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-2007066496-A1 BENZOYLUREA COMPOUND AND USE THEREOF SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2007-06-14 WO disclosed