SCHEMBL5081647

SCHEMBL5081647

O=C1C=C(c2ccccc2)C(=O)N1Nc1ccc([N+](=O)[O-])cc1[N+](=O)[O-]

nearest known ligand 0.64

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 4/20 0.64
KMT2A Q03164 4/20 0.64
CTDSP1 Q9GZU7 1/20 0.64
MAPT P10636 9/20 0.52
ALDH1A1 P00352 3/20 0.52
NPSR1 Q6W5P4 3/20 0.52
GAA P10253 2/20 0.52
CCR6 P51684 2/20 0.52
HPGD P15428 2/20 0.52
ALOX12 P18054 2/20 0.52
CACNA1B Q00975 2/20 0.52
APBA1 Q02410 2/20 0.52
CTRC Q99895 1/20 0.47
LMNA P02545 3/20 0.47
HTT P42858 2/20 0.47
CRHBP P24387 1/20 0.45
CRHR2 Q13324 1/20 0.45
HCRTR1 O43613 1/20 0.44
S1PR4 O95977 1/20 0.44
HSP90AA1 P07900 1/20 0.44

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
SCHEMBL6757490 0.81 MAPT (0.52) MEN1KMT2ACTDSP1MAPTALDH1A1
SCHEMBL11862182 0.78 MEN1 (1.00) MEN1KMT2ACTDSP1MAPTALDH1A1
SCHEMBL28369939 0.76 MEN1 (0.68) MEN1KMT2ACTDSP1MAPTALDH1A1
SCHEMBL7851807 0.71 PTGDR2 (0.42) MEN1KMT2ACTDSP1MAPTALDH1A1
SCHEMBL7583394 0.71 MAPT (0.63) MEN1KMT2AMAPTALDH1A1NPSR1
SCHEMBL7582583 0.70 MAPT (1.00) MAPTALDH1A1NPSR1GAACCR6
SCHEMBL13304846 0.69 MEN1 (0.69) MEN1KMT2ACTDSP1MAPTALDH1A1
SCHEMBL293916 0.68 MAPT (0.72) MEN1KMT2AMAPTALDH1A1HPGD
SCHEMBL26496472 0.68 KMT2A (0.73) MEN1KMT2ACTDSP1MAPTALDH1A1
SCHEMBL151000 0.67 MAPT (0.47) MEN1KMT2AMAPTALDH1A1NPSR1

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
EP-1966255-A1 ANTI-REFLECTIVE COATINGS AZ Electronic Materials USA Corp. (US) 2008-09-10 EP disclosed
WO-2007052132-A1 ANTI-REFLECTIVE COATINGS AZ ELECTRONIC MATERIALS USA CORP. (DE) 2007-05-10 WO disclosed