SCHEMBL9505315

SCHEMBL9505315

O=C(O)Oc1cc(=O)n(-c2ccc(Cl)cc2)[nH]1

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALKBH5 Q6P6C2 5/20 0.61
ALDH1A1 P00352 5/20 0.44
KMT2A Q03164 5/20 0.44
MEN1 O00255 4/20 0.44
HTT P42858 4/20 0.44
HPGD P15428 2/20 0.44
MAPT P10636 6/20 0.43
KDM4E B2RXH2 3/20 0.43
SMN1; SMN2 Q16637 2/20 0.43
TDP1 Q9NUW8 1/20 0.43
MME P08473 1/20 0.43
GAA P10253 3/20 0.40
TSHR P16473 1/20 0.39
NPSR1 Q6W5P4 1/20 0.38
LMNA P02545 2/20 0.38
RECQL P46063 1/20 0.38
KDM4A O75164 1/20 0.37
KDM5A P29375 1/20 0.37
KDM4C Q9H3R0 1/20 0.37
KDM5B Q9UGL1 1/20 0.37

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
SCHEMBL9503892 0.86 TSHR (0.51) ALKBH5ALDH1A1KMT2AMEN1HTT
SCHEMBL11469612 0.85 ALKBH5 (0.46) ALKBH5ALDH1A1KMT2AMEN1HTT
SCHEMBL9507906 0.85 ALKBH5 (0.44) ALKBH5ALDH1A1KMT2AMEN1HTT
SCHEMBL1734462 0.81 CYP2C19 (0.43) ALKBH5ALDH1A1KMT2AMEN1HTT
SCHEMBL9505993 0.81 ALDH1A1 (0.41) ALKBH5ALDH1A1HTTMAPTKDM4E
SCHEMBL19322447 0.80 ALKBH5 (0.54) ALKBH5ALDH1A1KMT2AMEN1HTT
SCHEMBL10923063 0.77 TSHR (0.49) ALKBH5ALDH1A1KMT2AMEN1HTT
SCHEMBL9505312 0.76 ALKBH5 (1.00) ALKBH5ALDH1A1KMT2AMAPTKDM4E
SCHEMBL11218444 0.76 CA2 (0.39) ALKBH5ALDH1A1KMT2AMEN1HTT
SCHEMBL8007070 0.74 TSHR (0.49) ALKBH5ALDH1A1KMT2AMEN1HTT

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
EP-0297397-B1 PREPARATION OF DIAZO AND AZO COMPOUNDS BAYER AG (DE) 1993-08-04 EP disclosed
EP-0297397-A2 Preparation of diazo and azo compounds BAYER AG (DE) 1989-01-04 EP disclosed
EP-0093306-B1 METHODS FOR THE PREPARATION OF AZO COMPOUNDS, AND AZO COMPOUNDS BAYER AG (DE) 1986-09-24 EP disclosed
EP-0093306-A1 Methods for the preparation of azo compounds, and azo compounds BAYER AG (DE) 1983-11-09 EP disclosed