SCHEMBL30367238

SCHEMBL30367238

O=[N+]([O-])c1ccc(N(c2ccc(N(c3ccc([N+](=O)[O-])cc3)c3ccc4ccccc4c3)cc2)c2ccc3ccccc3c2)cc1

nearest known ligand 0.68

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 7/20 0.68
KMT2A Q03164 7/20 0.68
ALDH1A1 P00352 6/20 0.68
CRHBP P24387 2/20 0.68
CRHR2 Q13324 2/20 0.68
L3MBTL1 Q9Y468 2/20 0.68
ATM Q13315 1/20 0.68
TLR9 Q9NR96 1/20 0.68
MAOA P21397 1/20 0.47
MAOB P27338 1/20 0.47
LMNA P02545 1/20 0.45
MAPT P10636 5/20 0.44
RAB9A P51151 2/20 0.44
SMN1; SMN2 Q16637 1/20 0.44
IKBKB O14920 1/20 0.43
POLB P06746 2/20 0.42
THRB P10828 1/20 0.42
MCL1 Q07820 1/20 0.42
CTDSP1 Q9GZU7 1/20 0.42
ALPG P10696 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
SCHEMBL12047991 0.92 MEN1 (0.58) MEN1KMT2AALDH1A1CRHBPCRHR2
SCHEMBL12047827 0.90 ALDH1A1 (0.64) MEN1KMT2AALDH1A1CRHBPCRHR2
SCHEMBL12048455 0.89 ALDH1A1 (0.54) MEN1KMT2AALDH1A1CRHBPCRHR2
SCHEMBL28911286 0.87 PTGS2 (0.55) MEN1KMT2AALDH1A1CRHBPCRHR2
SCHEMBL12048047 0.86 KMT2A (0.55) MEN1KMT2AALDH1A1CRHBPCRHR2
SCHEMBL12048329 0.86 ALDH1A1 (0.59) MEN1KMT2AALDH1A1CRHBPCRHR2
SCHEMBL12048559 0.86 KMT2A (0.55) MEN1KMT2AALDH1A1CRHBPCRHR2
SCHEMBL9913000 0.84 MEN1 (0.49) MEN1KMT2AALDH1A1CRHBPCRHR2
SCHEMBL9912913 0.84 MEN1 (0.49) MEN1KMT2AALDH1A1CRHBPCRHR2
SCHEMBL28352318 0.84 ALDH1A1 (0.51) MEN1KMT2AALDH1A1CRHBPCRHR2

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
CN-109651284-B Triarylamine-containing oxazine polymer and preparation method and application thereof 黑龙江大学 2023-03-31 CN claimed
CN-109651284-B Triarylamine-containing oxazine polymer and preparation method and application thereof 黑龙江大学 2023-03-31 CN disclosed