SCHEMBL10697117

SCHEMBL10697117

NC(=O)c1c2ccccc2nc2cccc(CCCCCC(=O)O)c12

nearest known ligand 0.46

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
MAPT P10636 1/20 0.42
RXFP1 Q9HBX9 1/20 0.42
MEN1 O00255 1/20 0.42
KMT2A Q03164 1/20 0.42
TLR8 Q9NR97 1/20 0.41
LTB4R Q15722 6/20 0.40
F13A1 P00488 3/20 0.39
LTB4R2 Q9NPC1 1/20 0.38
ALOX15 P16050 1/20 0.38
HTT P42858 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
PARP1 P09874 1/20 0.38
PARP2 Q9UGN5 1/20 0.38
CYSLTR2 Q9NS75 1/20 0.38
CYSLTR1 Q9Y271 1/20 0.38
TBXAS1 P24557 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
SCHEMBL3402945 0.82 TDP1 (0.51) MAPTMEN1KMT2ASMN1; SMN2
SCHEMBL9424812 0.79 PARP1 (0.46) MEN1KMT2APARP1PARP2
SCHEMBL6274670 0.76 MAPT (0.51) MAPTRXFP1MEN1KMT2ALTB4R
SCHEMBL31536704 0.76 MAPT (0.51) MAPTRXFP1MEN1KMT2ALTB4R
SCHEMBL29078299 0.76 BID (0.53) MAPTTLR8ALOX15
SCHEMBL7105692 0.76 KMT2A (0.50) MAPTRXFP1MEN1KMT2ATLR8
SCHEMBL6673816 0.75 RXFP1 (0.44) MAPTRXFP1MEN1KMT2ATLR8
SCHEMBL1616841 0.74 TDP1 (0.59) MAPTRXFP1MEN1KMT2AF13A1
SCHEMBL3732554 0.74 TDP1 (0.59) MAPTRXFP1MEN1KMT2AF13A1
SCHEMBL710750 0.74 TDP1 (0.59) MAPTRXFP1MEN1KMT2AF13A1

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-0273115-A2 Chemiluminescent acridinium and phenanthridinium salts ABBOTT LABORATORIES (US) 1988-07-06 EP disclosed