SCHEMBL5482553

SCHEMBL5482553

NNC(=O)c1cccc2c1ccc1ccccc12

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HDAC8 Q9BY41 2/20 0.56
MMP3 P08254 1/20 0.56
PLK1 P53350 1/20 0.54
GAA P10253 2/20 0.53
MAPT P10636 2/20 0.53
KDM4E B2RXH2 1/20 0.53
ALDH1A1 P00352 1/20 0.53
MEN1 O00255 2/20 0.49
KMT2A Q03164 2/20 0.49
MITF O75030 1/20 0.49
NCOA1 Q15788 1/20 0.49
TDP1 Q9NUW8 1/20 0.49
NCOA3 Q9Y6Q9 1/20 0.49
HPRT1 P00492 1/20 0.48
CYP1A2 P05177 1/20 0.48
CYP3A4 P08684 1/20 0.48
CYP2D6 P10635 1/20 0.48
CYP2C9 P11712 1/20 0.48
CYP2C19 P33261 1/20 0.48
HIF1A Q16665 1/20 0.48

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
SCHEMBL145153 0.89 HDAC8 (0.69) HDAC8MMP3PLK1GAAMAPT
SCHEMBL28800606 0.87 GAA (0.53) HDAC8MMP3PLK1GAAMAPT
SCHEMBL808428 0.85 CTSD (0.52) HDAC8MMP3PLK1GAAMAPT
SCHEMBL712806 0.83 MAPT (0.50) HDAC8MMP3GAAMAPTKDM4E
SCHEMBL466508 0.81 MAPT (0.52) HDAC8MMP3PLK1GAAMAPT
SCHEMBL9062637 0.80 HPRT1 (0.54) HDAC8MMP3PLK1MAPTALDH1A1
SCHEMBL659571 0.80 KDM4E (0.59) HDAC8MMP3PLK1GAAMAPT
SCHEMBL30415690 0.80 KDM4E (0.59) HDAC8MMP3PLK1GAAMAPT
SCHEMBL27902907 0.80 KDM4E (0.59) HDAC8MMP3PLK1GAAMAPT
SCHEMBL2466597 0.80 MEN1 (0.65) HDAC8MMP3PLK1MAPTKDM4E

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1679346-B1 POLYACETAL RESIN COMPOSITION POLYPLASTICS CO (JP) 2012-11-14 EP disclosed
US-20070123617-A1 Polyacetal resin composition DEUTSCHE BANK AG, NEW YORK BRANCH, AS COLLATERAL AGENT 2007-05-31 US disclosed
EP-1679346-A1 POLYACETAL RESIN COMPOSITION Polyplastics Co., Ltd. (JP) 2006-07-12 EP disclosed