SCHEMBL8768064

SCHEMBL8768064

CC(C)c1cccc(C(=O)O)c1OC(=O)c1ccc(O)cc1

nearest known ligand 0.64

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
SENP1 Q9P0U3 1/20 0.44
CA12 O43570 2/20 0.44
CA1 P00915 2/20 0.44
CA2 P00918 2/20 0.44
CA7 P43166 2/20 0.44
CA9 Q16790 2/20 0.44
CA14 Q9ULX7 2/20 0.44
ESR1 P03372 2/20 0.43
ESR2 Q92731 2/20 0.43
ALDH1A1 P00352 2/20 0.43
GAA P10253 1/20 0.43
KMT2A Q03164 1/20 0.43
TDP1 Q9NUW8 1/20 0.43
MAPK1 P28482 1/20 0.40
KDM4E B2RXH2 1/20 0.40
HPGD P15428 1/20 0.40
HSD17B10 Q99714 1/20 0.40
LMNA P02545 1/20 0.38

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
SCHEMBL8778059 0.87 MAPT (0.41) SENP1CA12CA1CA2CA7
SCHEMBL8766835 0.81 ALDH1A1 (0.62) SENP1CA12CA1CA2CA7
SCHEMBL8767097 0.79 SENP1 (0.45) SENP1CA12CA1CA2CA7
SCHEMBL8380667 0.79 LMNA (0.51) KMT2ALMNA
SCHEMBL4333091 0.78 ALDH1A1 (0.45) ALDH1A1KDM4EHSD17B10LMNA
SCHEMBL4902432 0.78 ESR1 (0.50) CA12CA1CA2CA7CA9
SCHEMBL8768312 0.78 SENP1 (0.44) SENP1CA12CA1CA2CA7
SCHEMBL8778066 0.76 HNF4A (0.51) SENP1ESR1ESR2ALDH1A1HSD17B10
SCHEMBL8768028 0.76 SENP1 (0.46) SENP1CA12CA1CA2CA7
SCHEMBL7831533 0.76 KCNK3 (0.46) ALDH1A1TDP1MAPK1KDM4EHPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0585127-B1 Thermal Recording sheet JUJO PAPER CO LTD (JP) 1997-12-29 EP disclosed
EP-0570186-B1 Thermal recording sheet JUJO PAPER CO LTD (JP) 1997-08-13 EP disclosed
US-5405821-A Containing a 4-hydroxyphenylarylsulfone color developer NIPPON PAPER INDUSTRIES CO., LTD. (JP) 1995-04-11 US disclosed
EP-0570186-A1 Thermal recording sheet NIPPON PAPER INDUSTRIES CO., LTD. (JP) 1993-11-18 EP disclosed