SCHEMBL28044883

SCHEMBL28044883

Nc1ccc(-c2nc3cc(O)ccc3nc2-c2ccccc2)cc1

nearest known ligand 0.70

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 6/20 0.70
ATM Q13315 2/20 0.70
TLR9 Q9NR96 1/20 0.70
PIK3CG P48736 1/20 0.65
MEN1 O00255 5/20 0.64
ALDH1A1 P00352 5/20 0.61
MAPT P10636 4/20 0.61
LMNA P02545 2/20 0.61
GPR55 Q9Y2T6 1/20 0.61
RAD51 Q06609 1/20 0.55
L3MBTL1 Q9Y468 4/20 0.51
KDM4E B2RXH2 3/20 0.51
GAA P10253 2/20 0.51
HPGD P15428 2/20 0.51
NPC1 O15118 1/20 0.51
RAB9A P51151 1/20 0.51
SMN1; SMN2 Q16637 1/20 0.51
CYP3A4 P08684 1/20 0.51
CYP2C9 P11712 1/20 0.51
CYP2C19 P33261 1/20 0.51

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
SCHEMBL28044788 1.00 KMT2A (0.70) KMT2AATMTLR9PIK3CGMEN1
SCHEMBL28041643 0.90 KMT2A (0.81) KMT2AATMTLR9PIK3CGMEN1
SCHEMBL28041435 0.90 KMT2A (0.81) KMT2AATMTLR9PIK3CGMEN1
SCHEMBL28037634 0.90 KMT2A (0.79) KMT2AATMTLR9PIK3CGMEN1
SCHEMBL28037189 0.90 KMT2A (0.79) KMT2AATMTLR9PIK3CGMEN1
SCHEMBL8112060 0.90 KMT2A (0.71) KMT2AATMTLR9PIK3CGMEN1
SCHEMBL29831706 0.86 KMT2A (0.93) KMT2AATMTLR9PIK3CGMEN1
SCHEMBL22288238 0.86 KMT2A (0.93) KMT2AATMTLR9PIK3CGMEN1
SCHEMBL22288252 0.86 KMT2A (0.93) KMT2AATMTLR9PIK3CGMEN1
SCHEMBL29831570 0.86 KMT2A (0.93) KMT2AATMTLR9PIK3CGMEN1

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
CN-105153194-B Monoamine list phenolic quinoxalinyl benzoxazine and preparation method thereof 哈尔滨工程大学 2017-07-11 CN claimed
CN-105153194-A Monoamine-monophenol type quinoxalinylbenzoxazin and preparation method thereof UNIV HARBIN ENG 2015-12-16 CN claimed
CN-105153194-B Monoamine list phenolic quinoxalinyl benzoxazine and preparation method thereof 哈尔滨工程大学 2017-07-11 CN disclosed
CN-105153194-A Monoamine-monophenol type quinoxalinylbenzoxazin and preparation method thereof UNIV HARBIN ENG 2015-12-16 CN disclosed