SCHEMBL13655510

SCHEMBL13655510

COc1ccc(N(/N=C/c2ccc(N(c3ccc(C)cc3)c3ccc(C)cc3)cc2)c2ccc(OC)cc2)cc1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RELA Q04206 1/20 0.50
ALDH1A1 P00352 3/20 0.48
ACHE P22303 1/20 0.46
MEN1 O00255 3/20 0.45
KMT2A Q03164 3/20 0.45
CYP1A2 P05177 2/20 0.45
MAPT P10636 1/20 0.45
CYP2C9 P11712 1/20 0.45
CYP2C19 P33261 1/20 0.45
G6PC1 P35575 1/20 0.44
GRIN2D O15399 1/20 0.40
GRIN3B O60391 1/20 0.40
GRIN1 Q05586 1/20 0.40
GRIN2A Q12879 1/20 0.40
GRIN2B Q13224 1/20 0.40
GRIN2C Q14957 1/20 0.40
GRIN3A Q8TCU5 1/20 0.40
MAOA P21397 1/20 0.39
MAOB P27338 1/20 0.39
NPC1 O15118 2/20 0.39

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
SCHEMBL12677636 0.89 SMN1; SMN2 (0.48) ALDH1A1MEN1KMT2ACYP1A2MAPT
SCHEMBL15292551 0.89 SMN1; SMN2 (0.48) ALDH1A1MEN1KMT2ACYP1A2MAPT
SCHEMBL14342245 0.88 G6PC1 (0.55) RELAALDH1A1MEN1KMT2ACYP1A2
SCHEMBL13655507 0.88 G6PC1 (0.55) RELAALDH1A1MEN1KMT2ACYP1A2
SCHEMBL359917 0.83 MEN1 (0.48) ALDH1A1MEN1KMT2ACYP1A2MAPT
SCHEMBL1199116 0.83 MEN1 (0.48) ALDH1A1MEN1KMT2ACYP1A2MAPT
SCHEMBL1199348 0.83 MEN1 (0.48) ALDH1A1MEN1KMT2ACYP1A2MAPT
SCHEMBL1199117 0.83 MEN1 (0.48) ALDH1A1MEN1KMT2ACYP1A2MAPT
SCHEMBL12677649 0.83 MEN1 (0.48) ALDH1A1MEN1KMT2ACYP1A2MAPT
SCHEMBL9724304 0.82 ALDH1A1 (0.53) ALDH1A1MEN1KMT2AMAPTG6PC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090245867-A1 ELECTROPHOTOGRAPHIC PHOTORECEPTOR, ELECTROPHOTOGRAPHIC PHOTORECEPTOR CARTRIDGE, AND IMAGE FORMING APPARATUS MITSUBISHI CHEMICAL CORPORATION (JP) 2009-10-01 US disclosed
US-20090245867-A1 ELECTROPHOTOGRAPHIC PHOTORECEPTOR, ELECTROPHOTOGRAPHIC PHOTORECEPTOR CARTRIDGE, AND IMAGE FORMING APPARATUS MITSUBISHI CHEMICAL CORPORATION (JP) 2009-10-01 US disclosed