SCHEMBL11075299

SCHEMBL11075299

COC(=NC(=O)N(C)c1ccc(OC(F)(F)C(Cl)Cl)cc1)c1c(Cl)cccc1Cl

nearest known ligand 0.40

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
TLR7 Q9NYK1 2/20 0.40
GPBAR1 Q8TDU6 5/20 0.40
MEN1 O00255 4/20 0.36
KMT2A Q03164 4/20 0.36
NPC1 O15118 1/20 0.36
PTGS2 P35354 1/20 0.36
RAF1 P04049 1/20 0.33
GAA P10253 1/20 0.32
NPSR1 Q6W5P4 1/20 0.32
MAPT P10636 1/20 0.32
XBP1 P17861 1/20 0.32
POLB P06746 2/20 0.32
TDP1 Q9NUW8 1/20 0.32
TRPV1 Q8NER1 1/20 0.32
LMNA P02545 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.31
MCHR1 Q99705 1/20 0.31
TLR8 Q9NR97 1/20 0.31
TYK2 P29597 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
SCHEMBL11075295 1.00 TLR7 (0.40) TLR7GPBAR1MEN1KMT2ANPC1
SCHEMBL11073524 0.90 TLR7 (0.39) TLR7GPBAR1MEN1KMT2ANPC1
SCHEMBL11073526 0.90 TLR7 (0.39) TLR7GPBAR1MEN1KMT2ANPC1
SCHEMBL11074226 0.90 TLR7 (0.40) TLR7GPBAR1MEN1KMT2ANPC1
SCHEMBL11074223 0.90 TLR7 (0.40) TLR7GPBAR1MEN1KMT2ANPC1
SCHEMBL11079064 0.89 GPBAR1 (0.40) TLR7GPBAR1MEN1KMT2ANPC1
SCHEMBL11079068 0.89 GPBAR1 (0.40) TLR7GPBAR1MEN1KMT2ANPC1
SCHEMBL11080519 0.89 TDP1 (0.40) TLR7GPBAR1MEN1KMT2ANPC1
SCHEMBL11080525 0.89 TDP1 (0.40) TLR7GPBAR1MEN1KMT2ANPC1
SCHEMBL11071570 0.84 PTGS2 (0.44) TLR7MEN1KMT2ANPC1PTGS2

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
US-4431667-A Imino ethers useful for controlling insect and arachnoid pests THE UPJOHN COMPANY (US) 1984-02-14 US disclosed