SCHEMBL9719138

SCHEMBL9719138

Nc1ccccc1Cc1ccccc1Cc1ccccc1N

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP3A4 P08684 3/20 0.50
ALOX15 P16050 2/20 0.50
CASP1 P29466 1/20 0.50
CASP7 P55210 1/20 0.50
SMN1; SMN2 Q16637 1/20 0.50
SLC6A2 P23975 2/20 0.46
SLC6A4 P31645 2/20 0.46
AR P10275 1/20 0.44
HSPA5 P11021 1/20 0.43
L3MBTL1 Q9Y468 2/20 0.43
ALDH1A1 P00352 2/20 0.43
FDPS P14324 1/20 0.42
HTR2A P28223 1/20 0.39
POLB P06746 1/20 0.39
TSHR P16473 3/20 0.39
TDP1 Q9NUW8 2/20 0.38
MEN1 O00255 1/20 0.38
MAPT P10636 1/20 0.38
KMT2A Q03164 1/20 0.38
NPSR1 Q6W5P4 1/20 0.38

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
SCHEMBL29373097 0.97 CYP3A4 (0.53) CYP3A4ALOX15CASP1CASP7SMN1; SMN2
SCHEMBL36019 0.97 CYP3A4 (0.53) CYP3A4ALOX15CASP1CASP7SMN1; SMN2
SCHEMBL1759362 0.94 CYP3A4 (0.50) CYP3A4ALOX15CASP1CASP7SMN1; SMN2
Hydrochloric Acid SCHEMBL11743462 0.94 CYP3A4 (0.50) CYP3A4ALOX15CASP1CASP7SMN1; SMN2
Ammonia Solution, Strong SCHEMBL9517239 0.94 CYP3A4 (0.50) CYP3A4ALOX15CASP1CASP7SMN1; SMN2
Hydrochloric Acid SCHEMBL1759361 0.92 CYP3A4 (0.47) CYP3A4ALOX15CASP1CASP7SMN1; SMN2
SCHEMBL2782720 0.89 CYP3A4 (0.45) CYP3A4ALOX15CASP1CASP7SMN1; SMN2
SCHEMBL7624528 0.88 GABRA1 (0.44) CYP3A4ALOX15CASP1CASP7SMN1; SMN2
SCHEMBL6697852 0.88 AR (0.42) CYP3A4ALOX15CASP1CASP7SMN1; SMN2
SCHEMBL23496022 0.87 CYP3A4 (0.43) CYP3A4ALOX15CASP1CASP7SMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5136015-A Reacting an unsaturated bisimide and a lesser stoichiometric amount of diamine followed by a polyamine having 3 or more benzene rings MATSUSHITA ELECTRIC WORKS, LTD. (JP) 1992-08-04 US claimed
US-20160152785-A1 EPOXY RESIN COMPOSITION, PREPREG, AND CARBON FIBER-REINFORCED COMPOSITE MATERIAL TORAY INDUSTRIES, INC. (JP) 2016-06-02 US disclosed
US-5136015-A Reacting an unsaturated bisimide and a lesser stoichiometric amount of diamine followed by a polyamine having 3 or more benzene rings MATSUSHITA ELECTRIC WORKS, LTD. (JP) 1992-08-04 US disclosed