SCHEMBL5389734

SCHEMBL5389734

COCN(C(=O)NC(=O)c1c(F)cccc1Cl)c1ccc(SC(F)(F)F)cc1F

nearest known ligand 0.41

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
TLR7 Q9NYK1 3/20 0.39
TLR8 Q9NR97 7/20 0.38
LMNA P02545 1/20 0.38
GAA P10253 7/20 0.37
KDM4E B2RXH2 1/20 0.37
NPC1 O15118 1/20 0.37
ALDH1A1 P00352 1/20 0.37
MAPK1 P28482 1/20 0.37
MAPT P10636 2/20 0.36
RAB9A P51151 1/20 0.36
NPSR1 Q6W5P4 1/20 0.36
POLB P06746 1/20 0.36

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
SCHEMBL5314173 0.96 KDM4E (0.35) TLR7TLR8LMNAGAAKDM4E
SCHEMBL5312106 0.93 TRPA1 (0.35) TLR7TLR8LMNANPC1MAPT
SCHEMBL5314263 0.91 TLR7 (0.36) TLR7TLR8LMNAGAAKDM4E
SCHEMBL5313896 0.91 TLR7 (0.36) TLR7TLR8LMNAGAAKDM4E
SCHEMBL5314164 0.90 GAA (0.38) TLR7TLR8LMNAGAAMAPT
SCHEMBL5425678 0.88 P2RX7 (0.38) LMNA
SCHEMBL5313207 0.88 GAA (0.37) TLR7TLR8LMNAGAAKDM4E
SCHEMBL5315040 0.87 RXFP1 (0.35)
SCHEMBL5314713 0.86 TRPA1 (0.34) NPC1MAPTRAB9APOLB
SCHEMBL5314730 0.85 KMT2A (0.36) NPC1RAB9APOLB

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