SCHEMBL8064720

SCHEMBL8064720

CC(CO)CN(CC(C)CO)C(=O)c1ccc(C(N)=O)cc1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MLYCD O95822 4/20 0.46
PARP10 Q53GL7 4/20 0.42
PARP4 Q9UKK3 2/20 0.38
PARP1 P09874 2/20 0.38
HSD17B10 Q99714 2/20 0.38
CA1 P00915 1/20 0.38
CA2 P00918 1/20 0.38
PARP2 Q9UGN5 1/20 0.38
ALDH1A1 P00352 3/20 0.37
HPGD P15428 2/20 0.37
MAPT P10636 2/20 0.37
KMT2A Q03164 1/20 0.36
PARP15 Q460N3 1/20 0.36
PARP14 Q460N5 1/20 0.36
PARP16 Q8N5Y8 1/20 0.36
PARP11 Q9NR21 1/20 0.36
PLA2G10 O15496 1/20 0.36
PLA2G2A P14555 1/20 0.36
NOS1 P29475 1/20 0.36
RORC P51449 2/20 0.36

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
SCHEMBL31614111 0.83 MLYCD (0.49) MLYCDPARP10PARP4PARP1HSD17B10
SCHEMBL9717459 0.83 MLYCD (0.49) MLYCDPARP10PARP4PARP1HSD17B10
SCHEMBL10325024 0.78 MLYCD (0.40) MLYCDPARP10HSD17B10ALDH1A1PLA2G10
SCHEMBL5316538 0.76 PARP10 (0.45) MLYCDPARP10PARP4PARP1HSD17B10
SCHEMBL1018549 0.74 HPGD (0.61) MLYCDPARP10ALDH1A1HPGDMAPT
SCHEMBL4807813 0.73 MLYCD (0.40) MLYCDPARP10PARP4PARP1HSD17B10
SCHEMBL5664687 0.73 ALDH1A1 (0.42) MLYCDPARP10PARP4PARP1HSD17B10
SCHEMBL28278838 0.72 MLYCD (0.62) MLYCDPARP10ALDH1A1HPGDMAPT
SCHEMBL2882577 0.71 NPSR1 (0.54) PARP10PARP4PARP1HSD17B10CA1
SCHEMBL16681496 0.70 NTRK2 (0.49) MLYCDPARP10PARP4PARP1HSD17B10

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6090516-A Polyester toner composition for electrophotographic imaging systems HOECHST CELANESE CORPORATION (US) 2000-07-18 US claimed
EP-1012673-A1 POLYESTER TONER MICROSPHERES FOR ELECTROPHOTOGRAPHIC IMAGING SYSTEMS Ticona LLC (US) 2000-06-28 EP claimed
EP-1009777-A1 POLYESTER TONER COMPOSITION FOR ELECTROPHOTOGRAPHIC IMAGING SYSTEMS Ticona LLC (US) 2000-06-21 EP claimed
WO-1999011720-A1 POLYESTER TONER COMPOSITION FOR ELECTROPHOTOGRAPHIC IMAGING SYSTEMS TICONA LLC (US) 1999-03-11 WO claimed
WO-1999012077-A1 POLYESTER TONER MICROSPHERES FOR ELECTROPHOTOGRAPHIC IMAGING SYSTEMS TICONA LLC (US) 1999-03-11 WO claimed
US-5843609-A Polyester toner microspheres for electrophotographic imaging systems HOECHST CELANESE CORP. (US) 1998-12-01 US claimed
US-6090973-A Polyester toner composition for electrophotographic imaging systems HOECHST CELANESE CORPORATION (US) 2000-07-18 US disclosed
US-6090516-A Polyester toner composition for electrophotographic imaging systems HOECHST CELANESE CORPORATION (US) 2000-07-18 US disclosed
US-6001980-A Polyester toner composition for electrophotographic imaging systems HOECHST CELANESE CORPORATION (US) 1999-12-14 US disclosed