SCHEMBL28405679

SCHEMBL28405679

CC(C)(C)c1cc([N+](=O)[O-])c(Nc2ccccc2O)c([N+](=O)[O-])c1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GAA P10253 6/20 0.56
MEN1 O00255 5/20 0.56
KMT2A Q03164 5/20 0.56
MAPK1 P28482 6/20 0.49
ALDH1A1 P00352 3/20 0.49
NPC1 O15118 2/20 0.49
RAB9A P51151 2/20 0.49
HTT P42858 2/20 0.49
GLA P06280 1/20 0.49
CASP3 P42574 1/20 0.49
SENP8 Q96LD8 1/20 0.49
SENP7 Q9BQF6 1/20 0.49
SENP6 Q9GZR1 1/20 0.49
POLB P06746 2/20 0.46
L3MBTL1 Q9Y468 2/20 0.46
UQCRB P14927 1/20 0.45
HSD17B2 P37059 1/20 0.45
LMNA P02545 2/20 0.44
MAPT P10636 2/20 0.44
GPR35 Q9HC97 1/20 0.43

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
SCHEMBL10801744 0.87 MAPK1 (0.53) GAAMEN1KMT2AMAPK1ALDH1A1
SCHEMBL10797260 0.83 MAPK1 (0.62) GAAMEN1KMT2AMAPK1ALDH1A1
SCHEMBL10803243 0.83 MAPK1 (0.48) GAAMEN1KMT2AMAPK1ALDH1A1
SCHEMBL11152164 0.82 MEN1 (0.61) GAAMEN1KMT2AMAPK1ALDH1A1
SCHEMBL2043906 0.81 MEN1 (0.58) GAAMEN1KMT2AMAPK1ALDH1A1
SCHEMBL10799433 0.80 MEN1 (0.55) GAAMEN1KMT2AMAPK1ALDH1A1
SCHEMBL28400089 0.78 MAPT (0.50) MEN1KMT2AMAPK1ALDH1A1NPC1
SCHEMBL10799904 0.76 MAPT (0.52) GAAMEN1KMT2AMAPK1ALDH1A1
SCHEMBL9119303 0.75 MEN1 (0.56) GAAMEN1KMT2AMAPK1ALDH1A1
SCHEMBL27083675 0.75 MAPK1 (0.53) GAAMEN1KMT2AMAPK1ALDH1A1

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
CN-107915748-B Preparation method of 4- (tert-butyl) -1-phenyl-imidazo [4,5,1-kl ] phenoxazine 华东师范大学 2020-05-12 CN claimed
CN-107915748-B Preparation method of 4- (tert-butyl) -1-phenyl-imidazo [4,5,1-kl ] phenoxazine 华东师范大学 2020-05-12 CN disclosed
CN-107915748-B Preparation method of 4- (tert-butyl) -1-phenyl-imidazo [4,5,1-kl ] phenoxazine 华东师范大学 2020-05-12 CN disclosed