SCHEMBL8078627

SCHEMBL8078627

Cc1cc(Sc2ccccc2)c2c(c1C)C(=O)c1ccccc1C2=O

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ADORA2A P29274 1/20 0.61
MAPT P10636 3/20 0.49
MAPK1 P28482 2/20 0.49
KDM4E B2RXH2 1/20 0.49
NSD2 O96028 1/20 0.49
MEN1 O00255 2/20 0.42
KMT2A Q03164 2/20 0.42
L3MBTL1 Q9Y468 2/20 0.42
HKDC1 Q2TB90 2/20 0.42
NPSR1 Q6W5P4 1/20 0.42
TDP1 Q9NUW8 1/20 0.42
PTPN1 P18031 1/20 0.42
CDC25A P30304 1/20 0.42
CDC25B P30305 1/20 0.42
ALDH1A1 P00352 2/20 0.41
TTR P02766 2/20 0.41
CYP1A1 P04798 1/20 0.39
CYP1A2 P05177 1/20 0.39
BCL2 P10415 1/20 0.39
MCL1 Q07820 1/20 0.39

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
SCHEMBL8089974 0.81 ADORA2A (0.60) ADORA2AMAPTMAPK1KDM4ENSD2
SCHEMBL14580985 0.79 MAPT (0.67) ADORA2AMAPTMAPK1KDM4ENSD2
SCHEMBL13944330 0.76 ADORA2A (1.00) ADORA2AMAPTMAPK1KDM4ENSD2
SCHEMBL6905929 0.76 ELANE (0.52) ADORA2AMAPTMAPK1KDM4ENSD2
SCHEMBL9163354 0.73 ADORA2A (0.76) ADORA2AMAPTMAPK1KDM4ENSD2
SCHEMBL10605899 0.73 ADORA2A (0.58) ADORA2AMAPTMAPK1NSD2MEN1
SCHEMBL7059068 0.72 RHEB (0.39) ADORA2AMAPTMAPK1KDM4ENSD2
SCHEMBL12402088 0.72 ADORA2A (0.47) ADORA2AMAPTMAPK1KDM4ENSD2
SCHEMBL285567 0.71 MAPT (0.89) ADORA2AMAPTMAPK1KDM4ENSD2
Anthraquinone SCHEMBL11411972 0.71 MAPT (0.89) ADORA2AMAPTMAPK1KDM4ENSD2

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
US-6054501-A CURABILITY; GLOSSINESS; CAN BE BLENDED WITH INKS, PAINTS NIPPON KAYAKU KABUSHIKI KAISHA (JP) 2000-04-25 US disclosed
EP-0844255-A1 PHOTOPOLYMERIZATION INITIATOR AND ACTINIC RADIATION-CURABLE COMPOSITION COMPRISING THE SAME NIPPON KAYAKU KABUSHIKI KAISHA (JP) 1998-05-27 EP disclosed