SCHEMBL10495337

SCHEMBL10495337

C[S+](C)(C)=O.O=C([O-])c1cc(Oc2c(Cl)cc(C(F)(F)F)cc2Cl)ccc1Cl

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.42
TTR P02766 1/20 0.42
PPOX P50336 1/20 0.42
KMT2A Q03164 1/20 0.42
TDP1 Q9NUW8 1/20 0.42
THRB P10828 4/20 0.40
THRA P10827 3/20 0.39
MRGPRX4 Q96LA9 1/20 0.37
NPBWR1 P48145 1/20 0.35
MCHR1 Q99705 1/20 0.35
FFAR1 O14842 2/20 0.35
LMNA P02545 1/20 0.35
SMN1; SMN2 Q16637 2/20 0.34
CYP11B1 P15538 1/20 0.34
CYP11B2 P19099 1/20 0.34
KDM4E B2RXH2 1/20 0.34
ALDH1A1 P00352 1/20 0.34
P2RX1 P51575 1/20 0.34
TMPRSS4 Q9NRS4 1/20 0.34
TLR8 Q9NR97 1/20 0.34

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
SCHEMBL10495336 1.00 MEN1 (0.42) MEN1TTRPPOXKMT2ATDP1
SCHEMBL10495354 0.91 MEN1 (0.42) MEN1TTRPPOXKMT2ATDP1
SCHEMBL10667115 0.82 MEN1 (0.52) MEN1TTRPPOXKMT2ATDP1
SCHEMBL11858023 0.81 CFTR (0.45) MEN1TTRPPOXKMT2ATDP1
SCHEMBL10667767 0.76 SCN9A (0.52) MRGPRX4
SCHEMBL11123698 0.76 TLR8 (0.48) MEN1TTRPPOXKMT2ATDP1
SCHEMBL9751312 0.75 MEN1 (0.41) MEN1TTRPPOXKMT2ATDP1
SCHEMBL9751346 0.75 MEN1 (0.48) MEN1TTRPPOXKMT2ATDP1
SCHEMBL10809942 0.74 RAF1 (0.45) ALDH1A1TLR8TLR7
Acifluorfen SCHEMBL10495355 0.74 MEN1 (0.76) MEN1TTRPPOXKMT2ATDP1

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-4806682-A Sulfonium salts of diphenyl ethers ROHM AND HAAS COMPANY (US) 1989-02-21 US disclosed