SCHEMBL9504179

SCHEMBL9504179

O=C(Nc1nc(O)cc(O)n1)c1ccccc1

nearest known ligand 0.65

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ADORA1 P30542 4/20 0.65
L3MBTL1 Q9Y468 1/20 0.55
KMT2A Q03164 3/20 0.55
MEN1 O00255 2/20 0.55
ADORA3 P0DMS8 4/20 0.53
KCNK3 O14649 1/20 0.52
KCNK9 Q9NPC2 1/20 0.52
F2 P00734 3/20 0.51
F12 P00748 2/20 0.51
ADORA2A P29274 1/20 0.51
NPC1 O15118 3/20 0.50
RAB9A P51151 3/20 0.50
SMN1; SMN2 Q16637 2/20 0.50
MAPK1 P28482 1/20 0.50
TP53 P04637 1/20 0.50
MAPT P10636 1/20 0.50
LMNA P02545 1/20 0.49
JAK2 O60674 1/20 0.49
TYK2 P29597 1/20 0.49
CYP1A2 P05177 1/20 0.48

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
SCHEMBL822059 0.90 ADORA1 (0.58) ADORA1L3MBTL1KMT2AMEN1ADORA3
SCHEMBL11172212 0.89 ADORA1 (0.56) ADORA1L3MBTL1KMT2AMEN1ADORA3
SCHEMBL3299661 0.86 ADORA1 (0.70) ADORA1L3MBTL1KMT2AMEN1ADORA3
SCHEMBL11166514 0.80 ADORA1 (0.63) ADORA1L3MBTL1KMT2AMEN1ADORA3
SCHEMBL10148930 0.79 NQO2 (0.52) ADORA1KMT2AMEN1ADORA3MAPT
SCHEMBL6498848 0.79 ADORA1 (1.00) ADORA1ADORA3F2F12ADORA2A
SCHEMBL2623093 0.78 L3MBTL1 (0.64) ADORA1L3MBTL1KMT2AMEN1ADORA3
SCHEMBL9564262 0.78 ADORA1 (0.60) ADORA1L3MBTL1KMT2AMEN1ADORA3
SCHEMBL2623094 0.78 ADORA1 (0.60) ADORA1L3MBTL1KMT2AMEN1ADORA3
SCHEMBL9566583 0.78 ADORA1 (0.70) ADORA1L3MBTL1KMT2AMEN1ADORA3

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 6 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
US-4942225-A Preparation of diazo and azo compounds using azidoformamidium salts BAYER AKTIENGESELLSCHAFT (DE) 1990-07-17 US disclosed
EP-0297397-A2 Preparation of diazo and azo compounds BAYER AG (DE) 1989-01-04 EP disclosed
US-4421601-A LACQUERS, INKS, PAINTS, TEXTILES, PAPER BAYER AKTIENGESELLSCHAFT (DE) 1983-12-20 US disclosed
EP-0093306-A1 Methods for the preparation of azo compounds, and azo compounds BAYER AG (DE) 1983-11-09 EP disclosed
US-4014863-A LACQUERS, PRINTING INKS, PAINTS BAYER AKTIENGESELLSCHAFT (DT) 1977-03-29 US disclosed