SCHEMBL1104259

SCHEMBL1104259

CC(CO)(CO)COC(=O)c1cc(C(=O)O)ccc1C(=O)O

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.43
TDP1 Q9NUW8 2/20 0.41
ALDH1A1 P00352 3/20 0.39
MAPK1 P28482 2/20 0.39
TSHR P16473 1/20 0.39
LMNA P02545 1/20 0.39
RAB9A P51151 1/20 0.39
ACE2 Q9BYF1 3/20 0.38
CDC25A P30304 1/20 0.37
CDC25B P30305 1/20 0.37
HSD17B10 Q99714 1/20 0.37
MYC P01106 1/20 0.37
POLB P06746 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
MAPT P10636 1/20 0.36
HIF1A Q16665 1/20 0.35
CA12 O43570 1/20 0.35
CA1 P00915 1/20 0.35
CA2 P00918 1/20 0.35
CA4 P22748 1/20 0.35

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
SCHEMBL11853671 0.90 HSD17B10 (0.41) KDM4ETDP1ALDH1A1MAPK1TSHR
SCHEMBL11372672 0.89 KDM4E (0.43) KDM4ETDP1ALDH1A1MAPK1TSHR
Ethylene Glycol SCHEMBL5687572 0.86 KDM4E (0.43) KDM4ETDP1ALDH1A1MAPK1TSHR
SCHEMBL10408523 0.85 KDM4E (0.45) KDM4ETDP1ALDH1A1MAPK1TSHR
SCHEMBL1121797 0.83 KDM4E (0.41) KDM4ETDP1ALDH1A1MAPK1TSHR
SCHEMBL15260478 0.83 KDM4E (0.51) KDM4ETDP1ALDH1A1TSHRLMNA
SCHEMBL10105023 0.83 SERPINE1 (0.41) KDM4ETDP1ALDH1A1MAPK1TSHR
SCHEMBL1104298 0.82 ALDH1A1 (0.54) TDP1ALDH1A1MAPK1TSHRLMNA
SCHEMBL5709705 0.82 KDM4E (0.47) KDM4ETDP1ALDH1A1MAPK1TSHR
SCHEMBL261294 0.81 KDM4E (0.41) KDM4ETDP1ALDH1A1MAPK1TSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-3953403-A Powder coating composition TOYO BOSEKI KABUSHIKI KAISHA (JA) 1976-04-27 US claimed
US-8151705-B2 Method of preparing lithographic printing plate FUJIFILM CORPORATION (JP) 2012-04-10 US disclosed
US-8151705-B2 Method of preparing lithographic printing plate FUJIFILM CORPORATION (JP) 2012-04-10 US disclosed
US-20100081771-A1 METHOD OF PREPARING LITHOGRAPHIC PRINTING PLATE FUJIFILM CORPORATION (JP) 2010-04-01 US disclosed
US-20100081771-A1 METHOD OF PREPARING LITHOGRAPHIC PRINTING PLATE FUJIFILM CORPORATION (JP) 2010-04-01 US disclosed
US-3953403-A Powder coating composition TOYO BOSEKI KABUSHIKI KAISHA (JA) 1976-04-27 US disclosed