SCHEMBL28037618

SCHEMBL28037618

Oc1ccc(-c2nc3c(O)cccc3nc2-c2ccccc2)cc1

nearest known ligand 0.71

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 5/20 0.71
MEN1 O00255 3/20 0.71
L3MBTL1 Q9Y468 3/20 0.56
ACHE P22303 1/20 0.55
MAPT P10636 3/20 0.55
NPSR1 Q6W5P4 3/20 0.55
GAA P10253 2/20 0.55
ALDH1A1 P00352 2/20 0.55
RAB9A P51151 1/20 0.55
KDM4E B2RXH2 2/20 0.47
LMNA P02545 2/20 0.47
TDP1 Q9NUW8 2/20 0.47
DHODH Q02127 2/20 0.47
MMP3 P08254 1/20 0.45
BCL2L1 Q07817 1/20 0.45
NQO2 P16083 1/20 0.44
ADORA2A P29274 1/20 0.43
ADORA1 P30542 1/20 0.43
CYP1A2 P05177 1/20 0.42
USP2 O75604 1/20 0.42

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
SCHEMBL8407376 1.00 KMT2A (0.71) KMT2AMEN1L3MBTL1ACHEMAPT
SCHEMBL8371593 0.93 ACHE (0.63) KMT2AMEN1L3MBTL1ACHEMAPT
SCHEMBL30575027 0.93 ACHE (0.63) KMT2AMEN1L3MBTL1ACHEMAPT
SCHEMBL28044888 0.87 KMT2A (0.53) KMT2AMEN1L3MBTL1ACHEMAPT
SCHEMBL8407551 0.87 TDP1 (0.67) KMT2AMEN1L3MBTL1ACHEMAPT
SCHEMBL28044889 0.87 KMT2A (0.53) KMT2AMEN1L3MBTL1ACHEMAPT
SCHEMBL8407328 0.85 KMT2A (0.51) KMT2AMEN1L3MBTL1ACHEMAPT
SCHEMBL3708123 0.84 L3MBTL1 (0.53) KMT2AMEN1L3MBTL1ACHEMAPT
SCHEMBL28041437 0.84 KMT2A (0.67) KMT2AMEN1L3MBTL1MAPTNPSR1
SCHEMBL28041439 0.84 KMT2A (0.67) KMT2AMEN1L3MBTL1MAPTNPSR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-105061466-A Main chain bisphenol type quinoxaline benzoxazine and preparation method thereof UNIV HARBIN ENG 2015-11-18 CN disclosed