SCHEMBL17635549

SCHEMBL17635549

CCCCN(CCCC)c1ccc(/N=N/c2cc[n+](CCC[N+](CC)(CC)CC)cc2)cc1

nearest known ligand 0.68

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CHRM2 P08172 2/20 0.68
CHRM4 P08173 2/20 0.68
CHRM5 P08912 2/20 0.68
CHRM1 P11229 2/20 0.68
CHRM3 P20309 2/20 0.68
KDM4A O75164 2/20 0.34
KDM2A Q9Y2K7 2/20 0.34
CHRNA7 P36544 1/20 0.34
CHRNA10 Q9GZZ6 1/20 0.34
CHRNA9 Q9UGM1 1/20 0.34
CNR2 P34972 1/20 0.34
MAPT P10636 4/20 0.33
KMT2A Q03164 4/20 0.33
MEN1 O00255 3/20 0.33
TP53 P04637 1/20 0.33
CYP1A2 P05177 1/20 0.33
CYP2D6 P10635 1/20 0.33
CYP2C9 P11712 1/20 0.33
CYP2C19 P33261 1/20 0.33
INSR P06213 1/20 0.33

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
SCHEMBL17635557 0.95 CHRM2 (0.62) CHRM2CHRM4CHRM5CHRM1CHRM3
Bromide SCHEMBL31672943 0.94 CHRM2 (0.64) CHRM2CHRM4CHRM5CHRM1CHRM3
SCHEMBL17705085 0.92 CHRM2 (0.58) CHRM2CHRM4CHRM5CHRM1CHRM3
SCHEMBL17705086 0.89 CHRM2 (0.58) CHRM2CHRM4CHRM5CHRM1CHRM3
SCHEMBL19494766 0.89 CHRM2 (0.58) CHRM2CHRM4CHRM5CHRM1CHRM3
SCHEMBL17635540 0.84 CHRM2 (0.50) CHRM2CHRM4CHRM5CHRM1CHRM3
SCHEMBL17705092 0.82 CHRM2 (0.45) CHRM2CHRM4CHRM5CHRM1CHRM3
SCHEMBL17705094 0.82 CHRM2 (0.45) CHRM2CHRM4CHRM5CHRM1CHRM3
SCHEMBL700294 0.82 CHRM2 (0.97) CHRM2CHRM4CHRM5CHRM1CHRM3
Bromide SCHEMBL1527120 0.81 CHRM2 (1.00) CHRM2CHRM4CHRM5CHRM1CHRM3

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3000848-B1 COMPOUND FOR GENERATING SECOND HARMONIC OF LIGHT, DYE COMPOSITION FOR GENERATING SECOND HARMONIC OF LIGHT, AND CELL EXAMINATION METHOD UNIV KEIO (JP) 2017-10-25 EP disclosed
US-9709555-B2 Compound for generating second harmonic of light, dye composition for generating second harmonic of light, and cell examination method KEIO UNIVERSITY (JP) 2017-07-18 US disclosed
US-20160116460-A1 COMPOUND FOR GENERATING SECOND HARMONIC OF LIGHT, DYE COMPOSITION FOR GENERATING SECOND HARMONIC OF LIGHT, AND CELL EXAMINATION METHOD KEIO UNIVERSITY (JP) 2016-04-28 US disclosed
EP-3000848-A1 COMPOUND FOR GENERATING SECOND HARMONIC OF LIGHT, DYE COMPOSITION FOR GENERATING SECOND HARMONIC OF LIGHT, AND CELL EXAMINATION METHOD Keio University (JP) 2016-03-30 EP disclosed