SCHEMBL5028366

SCHEMBL5028366

Oc1c(O)c2ccccc2c2ccc[c]c12

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PADI4 Q9UM07 1/20 0.38
HSP90AA1 P07900 1/20 0.38
KDM4E B2RXH2 3/20 0.35
MAPT P10636 3/20 0.35
MEN1 O00255 2/20 0.35
KMT2A Q03164 2/20 0.35
ALDH1A1 P00352 2/20 0.35
CACNA1B Q00975 2/20 0.35
APBA1 Q02410 2/20 0.35
GAA P10253 1/20 0.35
S100A4 P26447 1/20 0.35
THRB P10828 2/20 0.33
IDO1 P14902 1/20 0.33
NPC1 O15118 1/20 0.33
POLB P06746 1/20 0.33
RECQL P46063 1/20 0.33
RAB9A P51151 1/20 0.33
BLM P54132 1/20 0.33
MCL1 Q07820 1/20 0.33
TDP1 Q9NUW8 1/20 0.33

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
SCHEMBL10911446 0.84 KDM4E (0.37) PADI4HSP90AA1KDM4EMAPTMEN1
SCHEMBL4824194 0.81 HPRT1 (0.35) ALDH1A1THRBIDO1TDP1HPGD
SCHEMBL2407351 0.81 HPRT1 (0.35) ALDH1A1THRBIDO1TDP1HPGD
SCHEMBL24104 0.81 HPRT1 (0.35) ALDH1A1THRBIDO1TDP1HPGD
SCHEMBL2409495 0.78 CYP2A6 (0.33) ALDH1A1IDO1TDP1TSHRHSD17B10
SCHEMBL888293 0.75 PADI4 (0.55) PADI4HSP90AA1KDM4EMAPTMEN1
SCHEMBL30503415 0.75 PADI4 (0.55) PADI4HSP90AA1KDM4EMAPTMEN1
SCHEMBL2413265 0.73 HPRT1 (0.36) ALDH1A1THRBIDO1TDP1HPGD
SCHEMBL534967 0.73 ALDH1A1 (0.37) ALDH1A1THRBHPGDHSD17B10
SCHEMBL28496768 0.70 CYP1A2 (0.33) HSP90AA1NPC1RAB9AL3MBTL1HPGD

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-20080262127-A1 FLAME RESISTANT RESIN COMPOSITION CHANG CHUN PLASTICS CO., LTD. (TW) 2008-10-23 US disclosed