SCHEMBL8607785

SCHEMBL8607785

COC1C(C(=O)c2ccccc2S(C)(=O)=O)=C(C2CC2)ON1Cl

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 3/20 0.37
EED O75530 1/20 0.37
BCAT2 O15382 1/20 0.35
SLC9A1 P19634 1/20 0.33
HSD17B10 Q99714 1/20 0.32
HRH1 P35367 2/20 0.32
CCR3 P51677 2/20 0.32
CACNA1B Q00975 2/20 0.32
CA1 P00915 1/20 0.32
CA2 P00918 1/20 0.32
CA5A P35218 1/20 0.32
CA9 Q16790 1/20 0.32
CHRM2 P08172 1/20 0.31
CHRM4 P08173 1/20 0.31
CHRM5 P08912 1/20 0.31
CHRM1 P11229 1/20 0.31
CHRM3 P20309 1/20 0.31
MEN1 O00255 1/20 0.31
NPC1 O15118 1/20 0.31
RAB9A P51151 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
SCHEMBL8495604 0.81 POLB (0.36) LMNAEEDBCAT2SLC9A1HRH1
SCHEMBL8608337 0.80 EED (0.36) LMNAEEDBCAT2CA1CA2
SCHEMBL8608675 0.77 LMNA (0.38) LMNAEEDBCAT2SLC9A1HRH1
SCHEMBL8491954 0.77 LMNA (0.36) LMNAEEDBCAT2HSD17B10HRH1
SCHEMBL8762938 0.73 LMNA (0.38) LMNAEEDBCAT2SLC9A1CACNA1B
SCHEMBL8488843 0.72 BCAT2 (0.39) LMNAEEDBCAT2HRH1CCR3
SCHEMBL8608708 0.72 LMNA (0.38) LMNAEEDBCAT2SLC9A1CACNA1B
SCHEMBL8607350 0.71 BCAT2 (0.38) LMNAEEDBCAT2CACNA1BCA1
SCHEMBL8491655 0.71 TSHR (0.37) LMNAEEDBCAT2HSD17B10HRH1
SCHEMBL8606607 0.70 LMNA (0.43) LMNAEEDBCAT2SLC9A1HRH1

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-5804532-A REACTING A BENZOYL ISOXAZOLE WITH A BASE RHONE-POULENC AGRICULTURE LIMITED (GB) 1998-09-08 US disclosed