SCHEMBL14802149

SCHEMBL14802149

O=POc1cc(N2CCOCC2)cc2[nH]c3ccccc3c(=O)c12

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 4/20 0.47
MEN1 O00255 4/20 0.47
ALDH1A1 P00352 4/20 0.47
KMT2A Q03164 4/20 0.47
MAPT P10636 3/20 0.47
HPGD P15428 2/20 0.47
HSD17B10 Q99714 1/20 0.47
TDP1 Q9NUW8 1/20 0.47
L3MBTL1 Q9Y468 1/20 0.47
KIF11 P52732 4/20 0.44
ABCG2 Q9UNQ0 3/20 0.44
APAF1 O14727 1/20 0.42
CDC25B P30305 1/20 0.42
CASP3 P42574 1/20 0.42
SENP8 Q96LD8 1/20 0.42
SENP7 Q9BQF6 1/20 0.42
PIK3C3 Q8NEB9 1/20 0.41
PDGFRB P09619 2/20 0.40
FGFR1 P11362 1/20 0.40
FLT1 P17948 1/20 0.40

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
SCHEMBL14447679 0.85 ALDH1A1 (0.45) KDM4EMEN1ALDH1A1KMT2AMAPT
SCHEMBL5440644 0.80 PRKDC (0.55) KDM4EMEN1ALDH1A1KMT2AMAPT
SCHEMBL5801741 0.77 KIF11 (0.44) KDM4EMEN1ALDH1A1KMT2AMAPT
SCHEMBL5801743 0.72 PRKDC (0.42) KDM4EMEN1ALDH1A1KMT2AMAPT
SCHEMBL14802148 0.71 PRKDC (0.41) KDM4EMEN1KMT2AMAPTHPGD
SCHEMBL30965983 0.69 KIF11 (0.52) KDM4EMEN1ALDH1A1KMT2AMAPT
SCHEMBL13429255 0.66 ALDH1A1 (0.46) KDM4EMEN1ALDH1A1KMT2AMAPT
SCHEMBL5459622 0.66 PRKDC (0.45) MAPTKIF11PRKDC
SCHEMBL3729545 0.65 APAF1 (0.61) KDM4EMEN1ALDH1A1KMT2AMAPT
SCHEMBL5442834 0.64 PRKDC (0.48) KDM4EMEN1ALDH1A1KMT2AMAPT

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
US-8404681-B2 Xanthones, thioxanthones and acridinones as DNA-PK inhibitors LUITPOLD PHARMACEUTICALS, INC. (US) 2013-03-26 US disclosed