SCHEMBL859504

SCHEMBL859504

CC(C)CC(=O)ON1C(=O)c2ccc(S(=O)(=O)c3ccc4c(c3)C(=O)N(OC(=O)CC(C)C)C4=O)cc2C1=O

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.47
POLB P06746 3/20 0.41
TSHR P16473 2/20 0.38
GAA P10253 1/20 0.38
ATM Q13315 1/20 0.38
L3MBTL1 Q9Y468 1/20 0.38
HTT P42858 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
HPGD P15428 1/20 0.37
CA1 P00915 3/20 0.35
CA2 P00918 3/20 0.35
CA4 P22748 3/20 0.35
CA9 Q16790 3/20 0.35
PKM P14618 1/20 0.35
MAPT P10636 2/20 0.34
NPC1 O15118 1/20 0.34
RAB9A P51151 1/20 0.34
MDM2 Q00987 1/20 0.34
ALOX15 P16050 1/20 0.34
CASP1 P29466 1/20 0.34

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
SCHEMBL10203745 0.85 ALDH1A1 (0.36) ALDH1A1POLBTSHRGAAATM
SCHEMBL859771 0.83 ALDH1A1 (0.48) ALDH1A1POLBTSHRGAAATM
SCHEMBL859909 0.81 TDP1 (0.50) ALDH1A1POLBHTTSMN1; SMN2HPGD
SCHEMBL860107 0.81 ALDH1A1 (0.46) ALDH1A1POLBTSHRSMN1; SMN2HPGD
SCHEMBL859502 0.80 ALDH1A1 (0.54) ALDH1A1POLBTSHRGAAATM
SCHEMBL31463689 0.80 ALDH1A1 (0.47) ALDH1A1TSHRGAAMAPT
SCHEMBL860083 0.76 TNF (0.39) ALDH1A1L3MBTL1HPGDCA1CA9
SCHEMBL860126 0.72 ALDH1A1 (0.45) ALDH1A1POLBTSHRGAAATM
SCHEMBL859702 0.71 ALDH1A1 (0.46) ALDH1A1POLBTSHRGAAATM
SCHEMBL13814012 0.71 ALDH1A1 (0.43) ALDH1A1POLBCA1CA2CA4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8142983-B2 Lithographic printing plate precursor and method of lithographic printing FUJIFILM CORPORATION (JP) 2012-03-27 US disclosed
US-8142983-B2 Lithographic printing plate precursor and method of lithographic printing FUJIFILM CORPORATION (JP) 2012-03-27 US disclosed
US-20090233229-A1 LITHOGRAPHIC PRINTING PLATE PRECURSOR AND METHOD OF LITHOGRAPHIC PRINTING FUJIFILM CORPORATION (JP) 2009-09-17 US disclosed
US-20090233229-A1 LITHOGRAPHIC PRINTING PLATE PRECURSOR AND METHOD OF LITHOGRAPHIC PRINTING FUJIFILM CORPORATION (JP) 2009-09-17 US disclosed
EP-2100731-A2 Lithographic printing plate precursor and method of lithographic printing Fujifilm Corporation (JP) 2009-09-16 EP disclosed