SCHEMBL13985402

SCHEMBL13985402

O=C(Oc1ccccc1)c1c2ccccc2nc2ccc(O)cc12

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TRPV1 Q8NER1 1/20 0.45
ALDH1A1 P00352 6/20 0.45
KDM4E B2RXH2 4/20 0.45
HPGD P15428 2/20 0.45
HSD17B10 Q99714 2/20 0.45
PLA2G10 O15496 1/20 0.44
MEN1 O00255 8/20 0.44
KMT2A Q03164 8/20 0.44
GAA P10253 5/20 0.44
POLB P06746 5/20 0.44
LMNA P02545 4/20 0.44
NPC1 O15118 1/20 0.44
NPSR1 Q6W5P4 1/20 0.44
MAPT P10636 9/20 0.43
L3MBTL1 Q9Y468 3/20 0.43
HTT P42858 2/20 0.43
TDP1 Q9NUW8 2/20 0.43
GFER P55789 2/20 0.43
MAPK1 P28482 3/20 0.43
SMN1; SMN2 Q16637 1/20 0.43

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
SCHEMBL5705535 0.88 MAPT (0.50) ALDH1A1KDM4EHPGDHSD17B10MEN1
SCHEMBL27475817 0.83 KMT2A (0.51) ALDH1A1KDM4EHPGDHSD17B10MEN1
SCHEMBL3899416 0.82 DHODH (0.55) ALDH1A1KDM4EHPGDHSD17B10MEN1
SCHEMBL8142880 0.78 PLA2G2A (0.54) ALDH1A1KDM4EHPGDHSD17B10PLA2G10
SCHEMBL38661529 0.78 PLA2G2A (0.54) ALDH1A1KDM4EHPGDHSD17B10PLA2G10
SCHEMBL7104600 0.78 MEN1 (0.57) ALDH1A1KDM4EHPGDHSD17B10MEN1
SCHEMBL12088076 0.78 MEN1 (0.48) ALDH1A1KDM4EHPGDHSD17B10MEN1
SCHEMBL7020881 0.78 MAPT (0.51) ALDH1A1KDM4EHPGDMEN1KMT2A
SCHEMBL7045154 0.78 MAPT (0.56) ALDH1A1KDM4EMEN1KMT2AGAA
SCHEMBL7797045 0.78 MAPT (0.48) ALDH1A1KDM4EMEN1KMT2APOLB

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-7459284-B2 Chemiluminescent acridinium compounds and analogues thereof as substrates of hydrolytic enzymes SIEMENS HEALTHCARE DIAGNOSTICS INC. (US) 2008-12-02 US disclosed