SCHEMBL20124331

SCHEMBL20124331

C/C=C\c1c(C)nc2n(C)c3ccccc3n12

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ADORA1 P30542 6/20 0.46
KDM4E B2RXH2 3/20 0.41
ALDH1A1 P00352 3/20 0.41
L3MBTL1 Q9Y468 3/20 0.41
EGFR P00533 1/20 0.40
ADORA2B P29275 2/20 0.36
KMT2A Q03164 2/20 0.36
NPC1 O15118 2/20 0.36
MAPT P10636 2/20 0.36
RAB9A P51151 2/20 0.36
PKM P14618 1/20 0.36
MEN1 O00255 1/20 0.33
ATM Q13315 1/20 0.33
SMN1; SMN2 Q16637 2/20 0.33
ADORA2A P29274 1/20 0.33
LMNA P02545 1/20 0.33
POLB P06746 1/20 0.33
GAA P10253 1/20 0.33
HPGD P15428 1/20 0.33
MAPK1 P28482 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
SCHEMBL20124327 0.83 ADORA1 (0.47) ADORA1KDM4EALDH1A1L3MBTL1EGFR
SCHEMBL19731966 0.82 ADORA1 (0.42) ADORA1KDM4EALDH1A1L3MBTL1EGFR
SCHEMBL20124332 0.81 ADORA1 (0.37) ADORA1KDM4EALDH1A1L3MBTL1EGFR
SCHEMBL20094136 0.78 ADORA1 (0.37) ADORA1KDM4EALDH1A1L3MBTL1EGFR
SCHEMBL25638911 0.76 KDM4E (0.43) KDM4EALDH1A1L3MBTL1KMT2ANPC1
SCHEMBL19233749 0.73 ADORA1 (0.51) ADORA1KDM4EALDH1A1L3MBTL1EGFR
SCHEMBL20124326 0.73 KDM4E (0.43) KDM4EALDH1A1L3MBTL1KMT2ANPC1
SCHEMBL13317080 0.71 ADORA1 (0.66) ADORA1KDM4EALDH1A1L3MBTL1EGFR
SCHEMBL19054923 0.71 KDM4E (0.41) KDM4EALDH1A1L3MBTL1KMT2ANPC1
SCHEMBL21415870 0.71 KDM4E (0.41) KDM4EALDH1A1L3MBTL1KMT2ANPC1

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-3640252-A1 4H-IMIDAZO[1,2-A]IMIDAZOLES FOR ELECTRONIC APPLICATIONS UDC Ireland Limited (IE) 2020-04-22 EP disclosed
EP-3318566-A1 AZADIBENZOFURANS FOR ELECTRONIC APPLICATIONS UDC Ireland Limited (IE) 2018-05-09 EP disclosed