SCHEMBL22908381

SCHEMBL22908381

COc1ccc(OC)c2nc(-c3ccccc3)c(-c3ccccc3)nc12

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NQO2 P16083 3/20 0.61
L3MBTL1 Q9Y468 4/20 0.59
KDM4E B2RXH2 5/20 0.56
LMNA P02545 4/20 0.56
ALDH1A1 P00352 3/20 0.56
GAA P10253 1/20 0.56
NPSR1 Q6W5P4 1/20 0.52
TDP1 Q9NUW8 1/20 0.52
SMN1; SMN2 Q16637 3/20 0.51
MAPK1 P28482 2/20 0.51
RECQL P46063 1/20 0.51
WHR1 P49842 1/20 0.47
NPC1 O15118 1/20 0.46
NFKB1 P19838 1/20 0.46
RAB9A P51151 1/20 0.46
NFKB2 Q00653 1/20 0.46
RELA Q04206 1/20 0.46
ADORA1 P30542 1/20 0.45
HPGD P15428 2/20 0.45
KMT2A Q03164 2/20 0.45

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
SCHEMBL10934458 0.83 LMNA (0.66) NQO2L3MBTL1KDM4ELMNAALDH1A1
SCHEMBL14280963 0.79 SMN1; SMN2 (0.59) L3MBTL1KDM4ELMNAALDH1A1GAA
SCHEMBL16232472 0.78 SMN1; SMN2 (0.58) L3MBTL1KDM4ELMNAALDH1A1GAA
SCHEMBL25309375 0.77 NQO2 (0.68) NQO2L3MBTL1KDM4ELMNAALDH1A1
SCHEMBL13197741 0.77 LMNA (0.54) L3MBTL1KDM4ELMNAALDH1A1GAA
SCHEMBL19009922 0.76 SMN1; SMN2 (0.59) NQO2L3MBTL1KDM4ELMNAALDH1A1
SCHEMBL27694992 0.76 L3MBTL1 (0.55) L3MBTL1KDM4ELMNAALDH1A1GAA
SCHEMBL7117069 0.76 PDE10A (0.54) NQO2L3MBTL1KDM4ELMNAALDH1A1
SCHEMBL22671417 0.75 L3MBTL1 (0.50) NQO2L3MBTL1KDM4ELMNAALDH1A1
SCHEMBL15075259 0.74 L3MBTL1 (1.00) NQO2L3MBTL1KDM4ELMNAALDH1A1

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20210017315-A1 CURED PRODUCT, OPTICAL MEMBER, LENS, AND COMPOUND FUJIFILM CORPORATION (JP) 2021-01-21 US disclosed