SCHEMBL7905008

SCHEMBL7905008

CC(C)(C)CC(C)(C)OOC(=O)c1ccccc1C(=O)c1ccccc1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.47
TSHR P16473 1/20 0.47
HSD17B10 Q99714 1/20 0.47
TDP1 Q9NUW8 1/20 0.47
AKR1C3 P42330 2/20 0.45
ELANE P08246 3/20 0.44
L3MBTL1 Q9Y468 4/20 0.44
CYP1A2 P05177 1/20 0.44
CYP3A4 P08684 1/20 0.44
CYP2C9 P11712 1/20 0.44
CYP2C19 P33261 1/20 0.44
NPSR1 Q6W5P4 1/20 0.44
LMNA P02545 1/20 0.42
POLB P06746 2/20 0.41
MEN1 O00255 2/20 0.39
KMT2A Q03164 2/20 0.39
GAA P10253 1/20 0.39
MAPT P10636 1/20 0.39
CDC25B P30305 1/20 0.37
ATM Q13315 1/20 0.37

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
SCHEMBL6708934 0.88 ALDH1A1 (0.54) ALDH1A1TSHRHSD17B10TDP1AKR1C3
SCHEMBL4612232 0.87 ELANE (0.49) ALDH1A1TSHRHSD17B10TDP1AKR1C3
SCHEMBL6159772 0.85 ALDH1A1 (0.42) ALDH1A1TSHRHSD17B10TDP1AKR1C3
SCHEMBL3677745 0.85 TDP1 (0.66) ALDH1A1TSHRHSD17B10TDP1L3MBTL1
SCHEMBL7907952 0.84 ALDH1A1 (0.46) ALDH1A1TSHRHSD17B10TDP1AKR1C3
SCHEMBL29388336 0.83 ALDH1A1 (0.69) ALDH1A1TSHRHSD17B10TDP1AKR1C3
SCHEMBL1815675 0.83 ALDH1A1 (0.69) ALDH1A1TSHRHSD17B10TDP1AKR1C3
SCHEMBL7905010 0.81 TSHR (0.44) ALDH1A1TSHRHSD17B10TDP1AKR1C3
SCHEMBL6847666 0.79 ALDH1A1 (0.50) ALDH1A1TSHRHSD17B10TDP1AKR1C3
SCHEMBL9795518 0.79 ALDH1A1 (0.50) ALDH1A1TSHRHSD17B10TDP1AKR1C3

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-0520364-B1 Photopolymerizable composition FUJI PHOTO FILM CO LTD (JP) 1997-09-17 EP claimed
CN-108139673-B Metal oxide containing materials, methods of making and methods of using the same 默克专利有限公司 2021-06-15 CN disclosed
CN-108698427-B Cylindrical printing plate, cylindrical printing plate precursor, and method for producing same 富士胶片株式会社 2020-01-14 CN disclosed
EP-1096314-A1 Lithographic printing plate precursor FUJI PHOTO FILM CO., LTD. (JP) 2001-05-02 EP disclosed