SCHEMBL10697133

SCHEMBL10697133

CC(OOc1ccccc1C(=O)O)OC(C)(C)c1ccccc1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 9/20 0.44
HSD17B10 Q99714 7/20 0.44
HPGD P15428 5/20 0.44
ALDH1A1 P00352 8/20 0.43
ESR1 P03372 1/20 0.43
ITGB3 P05106 1/20 0.43
ITGA2B P08514 1/20 0.43
HMGB1 P09429 1/20 0.43
TSHR P16473 1/20 0.43
GGT1 P19440 1/20 0.43
PTGS1 P23219 1/20 0.43
PTGS2 P35354 1/20 0.43
BLM P54132 1/20 0.43
NAPRT Q6XQN6 1/20 0.43
TDP1 Q9NUW8 1/20 0.43
HTT P42858 2/20 0.41
KMT2A Q03164 2/20 0.40
MEN1 O00255 1/20 0.40
RECQL P46063 1/20 0.40
CYP2C9 P11712 2/20 0.39

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
SCHEMBL10697129 0.78 KDM4E (0.40) KDM4EHSD17B10HPGDALDH1A1ESR1
SCHEMBL17010754 0.77 KDM4E (0.56) KDM4EHSD17B10HPGDALDH1A1ESR1
SCHEMBL9551796 0.77 KDM4E (0.49) KDM4EHSD17B10HPGDALDH1A1ESR1
SCHEMBL9129863 0.76 KDM4E (0.54) KDM4EHSD17B10HPGDALDH1A1ESR1
SCHEMBL30597291 0.76 KDM4E (0.53) KDM4EHSD17B10HPGDALDH1A1ESR1
SCHEMBL4442258 0.76 KDM4E (0.53) KDM4EHSD17B10HPGDALDH1A1ESR1
SCHEMBL10697509 0.73 HTT (0.47) KDM4EHSD17B10HPGDALDH1A1ESR1
SCHEMBL5268363 0.72 KDM4E (0.45) KDM4EHSD17B10HPGDALDH1A1ESR1
SCHEMBL10599630 0.72 KDM4E (0.44) KDM4EHSD17B10HPGDALDH1A1ESR1
SCHEMBL9395760 0.72 HPGD (0.48) KDM4EHSD17B10HPGDALDH1A1ESR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0275203-A2 Heat-sensitive recording material containing color forming components FUJI PHOTO FILM CO., LTD. (JP) 1988-07-20 EP disclosed