SCHEMBL1755741

SCHEMBL1755741

CC(=O)c1ccc(OCc2ccc(C(O)c3cccc(/C(N)=N/N)c3)cc2)c(-c2cccs2)c1O

nearest known ligand 0.37

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
MAPT P10636 1/20 0.37
CYP2C9 P11712 1/20 0.37
CYP2C19 P33261 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
TDP1 Q9NUW8 1/20 0.37
L3MBTL1 Q9Y468 1/20 0.37
C5AR1 P21730 1/20 0.34
TNFRSF1A P19438 4/20 0.33
CYSLTR1 Q9Y271 2/20 0.33
GRM2 Q14416 1/20 0.33
MEN1 O00255 1/20 0.32
KMT2A Q03164 1/20 0.32
TRPM8 Q7Z2W7 1/20 0.32
CYSLTR2 Q9NS75 1/20 0.31
CCR5 P51681 2/20 0.31
PTGER3 P43115 1/20 0.31
PDE5A O76074 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
SCHEMBL481417 0.89 MAPT (0.41) MAPTCYP2C9CYP2C19SMN1; SMN2TDP1
SCHEMBL8264070 0.88 MAPT (0.35) MAPTCYP2C9CYP2C19SMN1; SMN2TDP1
SCHEMBL1755775 0.84 MAPT (0.41) MAPTCYP2C9CYP2C19SMN1; SMN2TDP1
SCHEMBL1755709 0.84 MAPT (0.41) MAPTCYP2C9CYP2C19SMN1; SMN2TDP1
SCHEMBL1755713 0.83 MAPT (0.40) MAPTCYP2C9CYP2C19SMN1; SMN2TDP1
SCHEMBL1755735 0.83 CYSLTR1 (0.41) MAPTCYP2C9CYP2C19SMN1; SMN2TDP1
SCHEMBL10247574 0.82 GRM2 (0.42) MAPTCYP2C9CYP2C19SMN1; SMN2TDP1
SCHEMBL481115 0.80 CYSLTR1 (0.55) CYSLTR1GRM2CYSLTR2
SCHEMBL1755806 0.79 MAPT (0.35) MAPTCYP2C9CYP2C19SMN1; SMN2TDP1
SCHEMBL1755738 0.77 CYP2C9 (0.41) MAPTCYP2C9CYP2C19SMN1; SMN2TDP1

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-2441762-A1 Potentiators of Glutamate Receptors Eli Lilly and Company (US) 2012-04-18 EP disclosed