SCHEMBL8089974

SCHEMBL8089974

Cc1ccc(Sc2ccccc2)c2c1C(=O)c1ccccc1C2=O

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ADORA2A P29274 3/20 0.60
MAPT P10636 3/20 0.56
MAPK1 P28482 2/20 0.56
NSD2 O96028 2/20 0.56
KDM4E B2RXH2 1/20 0.56
L3MBTL1 Q9Y468 3/20 0.47
ALDH1A1 P00352 3/20 0.47
CYP3A4 P08684 2/20 0.47
TSHR P16473 2/20 0.47
NPC1 O15118 1/20 0.47
CASP3 P42574 1/20 0.47
RAB9A P51151 1/20 0.47
HBB P68871 1/20 0.47
SMN1; SMN2 Q16637 1/20 0.47
SENP7 Q9BQF6 1/20 0.47
SENP6 Q9GZR1 1/20 0.47
MEN1 O00255 2/20 0.45
KMT2A Q03164 2/20 0.45
HKDC1 Q2TB90 2/20 0.45
NPSR1 Q6W5P4 1/20 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
SCHEMBL14580985 0.89 MAPT (0.67) ADORA2AMAPTMAPK1NSD2KDM4E
SCHEMBL9846550 0.83 ADORA2A (0.65) ADORA2AMAPTMAPK1NSD2KDM4E
SCHEMBL8078627 0.81 ADORA2A (0.61) ADORA2AMAPTMAPK1NSD2KDM4E
SCHEMBL9846518 0.80 ADORA2A (0.56) ADORA2AMAPTMAPK1NSD2KDM4E
SCHEMBL10663800 0.80 MAPT (0.68) ADORA2AMAPTMAPK1NSD2KDM4E
SCHEMBL55743 0.80 ALDH1A1 (0.67) ADORA2AMAPTMAPK1NSD2KDM4E
SCHEMBL30886455 0.80 ALDH1A1 (0.67) ADORA2AMAPTMAPK1NSD2KDM4E
SCHEMBL22827087 0.79 MAPT (0.86) ADORA2AMAPTMAPK1NSD2KDM4E
SCHEMBL10811522 0.79 MAPT (0.68) ADORA2AMAPTMAPK1NSD2KDM4E
SCHEMBL285567 0.77 MAPT (0.89) ADORA2AMAPTMAPK1NSD2KDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7435270-B2 Pigment/dye mixtures HUNTSMAN INTERNATIONAL LLC (US) 2008-10-14 US disclosed
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