SCHEMBL8904224

SCHEMBL8904224

CN(C)C(c1ccc(N)cc1)c1ccc(C(c2ccc(N)cc2)N(C)C)cc1

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CHRNA7 P36544 1/20 0.61
ALDH1A1 P00352 11/20 0.46
TDP1 Q9NUW8 9/20 0.46
CYP3A4 P08684 9/20 0.46
MAPK1 P28482 5/20 0.46
ALOX15 P16050 3/20 0.46
TP53 P04637 2/20 0.46
MAPT P10636 3/20 0.42
MEN1 O00255 2/20 0.42
KMT2A Q03164 2/20 0.42
ACHE P22303 1/20 0.39
TSHR P16473 4/20 0.36
L3MBTL1 Q9Y468 3/20 0.36
GFER P55789 2/20 0.36
PSMD14 O00487 1/20 0.36
RECQL P46063 1/20 0.36
HIF1A Q16665 2/20 0.33
CA3 P07451 1/20 0.33
THRB P10828 1/20 0.33
CA6 P23280 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
SCHEMBL8905823 0.87 CHRNA7 (0.48) CHRNA7ALDH1A1TDP1CYP3A4MAPK1
SCHEMBL5375704 0.77 TDP1 (0.44) CHRNA7ALDH1A1TDP1CYP3A4MAPK1
SCHEMBL853383 0.77 TDP1 (0.44) CHRNA7ALDH1A1TDP1CYP3A4MAPK1
Hydrochloric Acid SCHEMBL6675940 0.75 ALDH1A1 (0.42) CHRNA7ALDH1A1TDP1CYP3A4MAPK1
Trimethylammonium SCHEMBL10350684 0.73 MAPT (0.67) ALDH1A1TDP1CYP3A4MAPK1ALOX15
SCHEMBL674996 0.72 CHRNA7 (0.59) CHRNA7ALDH1A1TDP1MEN1KMT2A
SCHEMBL28671135 0.72 TDP1 (0.44) ALDH1A1TDP1CYP3A4MAPK1ALOX15
SCHEMBL27691325 0.72 TDP1 (0.39) CHRNA7ALDH1A1TDP1CYP3A4MAPK1
SCHEMBL5955 0.71 MAPT (0.53) ALDH1A1TDP1CYP3A4MAPK1ALOX15
Hydrochloric Acid SCHEMBL11332719 0.70 CHRNA7 (0.56) CHRNA7ALDH1A1TDP1MAPK1MAPT

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
US-5650463-A Carbon fiber-reinforced polimide resin composition MITSUI TOATSU CHEMICALS, INC. (JP) 1997-07-22 US disclosed
US-5554765-A HEAT RESISTANCE MITSUI TOATSU CHEMICALS, INC. (JP) 1996-09-10 US disclosed
EP-0523240-B1 BISIMIDE COMPOUNDS, POLYIMIDE RESIN COMPOSITION PREPARED THEREFROM, AND CARBON FIBER-REINFORCED POLYIMIDE RESIN COMPOSITION MITSUI TOATSU CHEMICALS (JP) 1996-03-20 EP disclosed
US-5457154-A Melt processability MITSUI TOATSU CHEMICALS, INC. (JP) 1995-10-10 US disclosed