SCHEMBL9500318

SCHEMBL9500318

CC(C)(CC(=O)c1ccccc1)OOC(=O)c1ccccc1

nearest known ligand 0.64

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 5/20 0.64
ALDH1A1 P00352 4/20 0.64
TSHR P16473 2/20 0.64
HSD17B10 Q99714 1/20 0.64
LMNA P02545 2/20 0.52
F2 P00734 1/20 0.52
NPC1 O15118 4/20 0.44
RAB9A P51151 4/20 0.44
MAPK1 P28482 3/20 0.43
HIF1A Q16665 2/20 0.43
SMN1; SMN2 Q16637 3/20 0.42
MAPT P10636 3/20 0.42
HPGD P15428 3/20 0.42
KDM4E B2RXH2 1/20 0.42
MEN1 O00255 1/20 0.42
CYP3A4 P08684 1/20 0.42
ALOX15 P16050 1/20 0.42
CES1 P23141 1/20 0.42
KMT2A Q03164 1/20 0.42
POLB P06746 1/20 0.42

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
SCHEMBL7621583 0.88 KMT2A (0.50) TDP1ALDH1A1TSHRHSD17B10LMNA
SCHEMBL43962 0.86 TDP1 (0.72) TDP1ALDH1A1TSHRHSD17B10LMNA
SCHEMBL25264 0.83 TDP1 (0.68) TDP1ALDH1A1TSHRHSD17B10LMNA
SCHEMBL27551381 0.81 TDP1 (0.66) TDP1ALDH1A1TSHRHSD17B10LMNA
SCHEMBL28065040 0.81 TDP1 (0.66) TDP1ALDH1A1TSHRHSD17B10LMNA
SCHEMBL28808752 0.81 TDP1 (0.66) TDP1ALDH1A1TSHRHSD17B10LMNA
SCHEMBL28080657 0.81 TDP1 (0.83) TDP1ALDH1A1TSHRHSD17B10LMNA
SCHEMBL3677745 0.81 TDP1 (0.66) TDP1ALDH1A1TSHRHSD17B10LMNA
SCHEMBL1581942 0.80 KMT2A (0.50) TDP1ALDH1A1TSHRHSD17B10LMNA
SCHEMBL2464406 0.80 TDP1 (0.74) TDP1ALDH1A1TSHRHSD17B10LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0125140-B1 IMPROVEMENTS IN OR RELATING TO RADIATION SENSITIVE PLATES VICKERS PLC (GB) 1988-12-14 EP claimed
EP-0125140-A2 Improvements in or relating to radiation sensitive plates VICKERS PLC (GB) 1984-11-14 EP claimed
EP-0260823-B1 IMPROVEMENTS IN OR RELATING TO PRINTING PLATE PRECURSORS E.I. du Pont de Nemours and Company (US) 1993-06-09 EP disclosed
US-4999271-A Photopolymerizable urethane acrylate or methacrylate, lithography VICKERS PLC (GB) 1991-03-12 US disclosed
EP-0125140-B1 IMPROVEMENTS IN OR RELATING TO RADIATION SENSITIVE PLATES VICKERS PLC (GB) 1988-12-14 EP disclosed
EP-0260823-A2 Improvements in or relating to printing plate precursors E.I. du Pont de Nemours and Company (US) 1988-03-23 EP disclosed
EP-0125140-A2 Improvements in or relating to radiation sensitive plates VICKERS PLC (GB) 1984-11-14 EP disclosed