SCHEMBL11270946

SCHEMBL11270946

O=C(O)c1cc(Oc2ccc(C(F)(F)F)cc2Cl)cc(CCCCCCO)c1[N+](=O)[O-]

nearest known ligand 0.60

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.60
TTR P02766 1/20 0.60
PPOX P50336 1/20 0.60
KMT2A Q03164 1/20 0.60
TDP1 Q9NUW8 1/20 0.60
FFAR1 O14842 5/20 0.46
MRGPRX4 Q96LA9 10/20 0.42
PYGL P06737 1/20 0.39
LMNA P02545 1/20 0.36
POLB P06746 1/20 0.36
MAPT P10636 1/20 0.36
CCR6 P51684 1/20 0.36
NPSR1 Q6W5P4 1/20 0.36
GPR55 Q9Y2T6 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
SCHEMBL11270941 1.00 MEN1 (0.60) MEN1TTRPPOXKMT2ATDP1
SCHEMBL10500785 0.96 MEN1 (0.62) MEN1TTRPPOXKMT2ATDP1
SCHEMBL10500782 0.96 MEN1 (0.62) MEN1TTRPPOXKMT2ATDP1
SCHEMBL10499994 0.93 MEN1 (0.64) MEN1TTRPPOXKMT2ATDP1
SCHEMBL10499986 0.93 MEN1 (0.64) MEN1TTRPPOXKMT2ATDP1
SCHEMBL9788466 0.87 TDP1 (0.66) MEN1TTRPPOXKMT2ATDP1
SCHEMBL11065135 0.85 MEN1 (0.60) MEN1TTRPPOXKMT2ATDP1
SCHEMBL11273776 0.85 TDP1 (0.56) MEN1TTRPPOXKMT2ATDP1
SCHEMBL11274002 0.85 MEN1 (0.59) MEN1TTRPPOXKMT2ATDP1
SCHEMBL10500878 0.85 MEN1 (0.59) 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
EP-0066106-A1 New phenoxybenzoates, process for preparing these compounds, compositions containing them and method of use GAF CORPORATION (US) 1982-12-08 EP disclosed