SCHEMBL1755735

SCHEMBL1755735

CCc1c(OCc2ccc(C(O)c3cccc(/C(N)=N/N)c3)cc2)ccc(C(C)=O)c1O

nearest known ligand 0.41

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
CYSLTR1 Q9Y271 12/20 0.41
CYSLTR2 Q9NS75 2/20 0.41
MAPT P10636 1/20 0.40
CYP2C9 P11712 1/20 0.40
CYP2C19 P33261 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
TDP1 Q9NUW8 1/20 0.40
L3MBTL1 Q9Y468 1/20 0.40
GRM2 Q14416 10/20 0.39
PDE5A O76074 2/20 0.36
CTSD P07339 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
SCHEMBL1755709 0.89 MAPT (0.41) CYSLTR1CYSLTR2MAPTCYP2C9CYP2C19
SCHEMBL1755775 0.89 MAPT (0.41) CYSLTR1CYSLTR2MAPTCYP2C9CYP2C19
SCHEMBL1755713 0.88 MAPT (0.40) CYSLTR1CYSLTR2MAPTCYP2C9CYP2C19
SCHEMBL10247574 0.86 GRM2 (0.42) CYSLTR1MAPTCYP2C9CYP2C19SMN1; SMN2
SCHEMBL8263462 0.86 CYSLTR1 (0.49) CYSLTR1CYSLTR2MAPTGRM2PDE5A
SCHEMBL1755741 0.83 MAPT (0.37) CYSLTR1CYSLTR2MAPTCYP2C9CYP2C19
Ly-2300559 SCHEMBL481118 0.81 CYSLTR1 (0.59) CYSLTR1CYSLTR2MAPTGRM2PDE5A
Ly-2300559 SCHEMBL480820 0.81 CYSLTR1 (0.59) CYSLTR1CYSLTR2MAPTGRM2PDE5A
Ly-2300559 SCHEMBL8264028 0.81 CYSLTR1 (0.59) CYSLTR1CYSLTR2MAPTGRM2PDE5A
Ly-2300559 SCHEMBL481075 0.80 CYSLTR1 (0.58) CYSLTR1CYSLTR2MAPTGRM2PDE5A

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