SCHEMBL9386255

SCHEMBL9386255

CC(C)c1ccc(Oc2cc(O)c3c(c2N)C(=O)c2ccccc2C3=O)cc1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ADORA2A P29274 1/20 0.48
MAPT P10636 7/20 0.44
TDP1 Q9NUW8 5/20 0.44
POLB P06746 4/20 0.44
THRB P10828 3/20 0.44
RECQL P46063 2/20 0.44
SMN1; SMN2 Q16637 2/20 0.44
ESR2 Q92731 1/20 0.44
MEN1 O00255 7/20 0.42
KMT2A Q03164 7/20 0.42
HPGD P15428 3/20 0.42
MAPK1 P28482 3/20 0.42
CYP1A1 P04798 2/20 0.42
MAOA P21397 2/20 0.42
ALDH1A1 P00352 2/20 0.42
L3MBTL1 Q9Y468 2/20 0.42
KDM4E B2RXH2 2/20 0.42
DAPK1 P53355 2/20 0.42
TTR P02766 1/20 0.42
CYP3A4 P08684 1/20 0.42

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
SCHEMBL10812235 0.90 ADORA2A (0.52) ADORA2AMAPTTDP1POLBTHRB
SCHEMBL7769559 0.87 ADORA2A (0.50) ADORA2AMAPTTDP1POLBTHRB
SCHEMBL31037853 0.87 ADORA2A (0.50) ADORA2AMAPTTDP1POLBTHRB
SCHEMBL9156123 0.87 ADORA2A (0.50) ADORA2AMAPTTDP1POLBTHRB
SCHEMBL8731564 0.87 ADORA2A (0.50) ADORA2AMAPTTDP1POLBTHRB
SCHEMBL10086463 0.87 ADORA2A (0.52) ADORA2AMAPTTDP1POLBTHRB
SCHEMBL9154959 0.87 ADORA2A (0.52) ADORA2AMAPTTDP1POLBTHRB
SCHEMBL92475 0.87 ADORA2A (0.62) ADORA2AMAPTTDP1POLBTHRB
SCHEMBL10086341 0.85 ADORA2A (0.47) ADORA2AMAPTTDP1POLBTHRB
SCHEMBL11760891 0.85 ADORA2A (0.53) ADORA2AMAPTTDP1POLBTHRB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-1994004370-A1 THERMAL TRANSFER PRINTING IMPERIAL CHEMICALS INDUSTRIES PLC (GB) 1994-03-03 WO claimed
EP-2834288-B1 COLORED CHARGED SILSESQUIOXANES BASF SE (DE) 2017-04-26 EP disclosed
US-9228063-B2 Colored charged silsesquioxanes BASF SE (DE) 2016-01-05 US disclosed
US-20140296518-A1 Colored Charged Silsesquioxanes BASF SE (DE) 2014-10-02 US disclosed
WO-2013150444-A1 COLORED CHARGED SILSESQUIOXANES BASF SE (DE) 2013-10-10 WO disclosed
WO-1994004370-A1 THERMAL TRANSFER PRINTING IMPERIAL CHEMICALS INDUSTRIES PLC (GB) 1994-03-03 WO disclosed
US-4008222-A POLYESTERS BAYER AKTIENGESELLSCHAFT (DT) 1977-02-15 US disclosed