SCHEMBL3373253

SCHEMBL3373253

CC(=O)On1c2ccccc2c(=O)c2ccccc21

nearest known ligand 0.47

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
P2RX4 Q99571 5/20 0.47
GLA P06280 2/20 0.47
ALDH1A1 P00352 4/20 0.47
POLB P06746 1/20 0.46
PTGS2 P35354 2/20 0.44
KDM4E B2RXH2 2/20 0.42
HTT P42858 2/20 0.42
CYP2C19 P33261 2/20 0.42
HSD17B10 Q99714 2/20 0.42
GAA P10253 1/20 0.42
HPGD P15428 1/20 0.42
MAPT P10636 1/20 0.40
ATM Q13315 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
TP53 P04637 1/20 0.39
CREBBP Q92793 1/20 0.39
L3MBTL1 Q9Y468 1/20 0.38

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
SCHEMBL1906715 0.90 POLB (0.55) GLAALDH1A1POLBKDM4EHTT
SCHEMBL8431590 0.78 PARP1 (0.44) ALDH1A1POLBKDM4EHTTGAA
Ammonia Solution, Strong SCHEMBL6510414 0.76 MAT2A (0.38) ALDH1A1POLBKDM4EHTTHSD17B10
SCHEMBL9147581 0.76 KDM4E (0.43) GLAALDH1A1POLBKDM4EHSD17B10
SCHEMBL27620887 0.75 EGFR (0.45) ALDH1A1POLBKDM4EGAAHPGD
SCHEMBL6142952 0.75 HPGD (0.57) ALDH1A1POLBKDM4ECYP2C19HSD17B10
SCHEMBL12216219 0.75 POLB (0.80) P2RX4GLAALDH1A1POLBPTGS2
SCHEMBL27996393 0.74 POLB (0.42) GLAALDH1A1POLBKDM4EHTT
SCHEMBL7896123 0.73 ALDH1A1 (0.54) P2RX4GLAALDH1A1KDM4EHTT
SCHEMBL7073898 0.73 POLB (0.48) GLAALDH1A1POLBKDM4EHTT

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-1970372-B1 SALTS OF 9-OXOACRIDINE-10-ACETIC ACID WITH 1-ALKYLAMNO-1-DESOXY-POLYOLS EPHAG AS (EE) 2010-11-03 EP claimed