SCHEMBL20124327

SCHEMBL20124327

C=Cc1c(C)nc2n(C)c3ccccc3n12

nearest known ligand 0.49

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
ADORA1 P30542 6/20 0.47
KDM4E B2RXH2 3/20 0.42
ALDH1A1 P00352 2/20 0.42
L3MBTL1 Q9Y468 1/20 0.42
EGFR P00533 1/20 0.41
ADORA2B P29275 2/20 0.37
ATM Q13315 1/20 0.34
MEN1 O00255 1/20 0.34
KMT2A Q03164 1/20 0.34
HPGD P15428 2/20 0.33
ADORA2A P29274 1/20 0.33
POLB P06746 1/20 0.33
GAA P10253 1/20 0.33
MAPT P10636 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33

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
SCHEMBL20124331 0.83 ADORA1 (0.46) ADORA1KDM4EALDH1A1L3MBTL1EGFR
SCHEMBL20094136 0.79 ADORA1 (0.37) ADORA1KDM4EALDH1A1L3MBTL1EGFR
SCHEMBL19731966 0.78 ADORA1 (0.42) ADORA1KDM4EALDH1A1L3MBTL1EGFR
SCHEMBL19233749 0.75 ADORA1 (0.51) ADORA1KDM4EALDH1A1L3MBTL1EGFR
SCHEMBL13317080 0.72 ADORA1 (0.66) ADORA1KDM4EALDH1A1L3MBTL1EGFR
SCHEMBL636328 0.70 ADORA1 (0.62) ADORA1KDM4EALDH1A1L3MBTL1EGFR
SCHEMBL21415870 0.69 KDM4E (0.41) KDM4EALDH1A1L3MBTL1ATMMEN1
SCHEMBL19054923 0.69 KDM4E (0.41) KDM4EALDH1A1L3MBTL1ATMMEN1
SCHEMBL12799837 0.68 ATM (0.53) ADORA1KDM4EALDH1A1L3MBTL1EGFR
SCHEMBL19233748 0.68 ADORA1 (0.47) ADORA1KDM4EALDH1A1L3MBTL1EGFR

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
EP-3318566-A1 AZADIBENZOFURANS FOR ELECTRONIC APPLICATIONS UDC Ireland Limited (IE) 2018-05-09 EP disclosed