SCHEMBL7457484

SCHEMBL7457484

COC(=O)C(=CC(Cl)(Cl)Cl)C(=O)OC

nearest known ligand 0.39

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.35
TET2 Q6N021 1/20 0.33
MAPT P10636 1/20 0.32
HPGD P15428 1/20 0.32
RECQL P46063 1/20 0.32
KEAP1 Q14145 1/20 0.32
NFE2L2 Q16236 1/20 0.32
HCAR2 Q8TDS4 1/20 0.32
L3MBTL1 Q9Y468 1/20 0.31

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
SCHEMBL2417309 0.78 ALDH1A1 (0.39) ALDH1A1TET2MAPTKEAP1NFE2L2
SCHEMBL7868945 0.78 ALDH1A1 (0.39) ALDH1A1TET2MAPTKEAP1NFE2L2
SCHEMBL4009654 0.75 ALDH1A1 (0.35) ALDH1A1TET2MAPTHPGDRECQL
SCHEMBL7461903 0.75 TSHR (0.37) HCAR2
SCHEMBL7463697 0.75 NPSR1 (0.52) ALDH1A1MAPT
SCHEMBL11321706 0.73 MAPT (0.39) ALDH1A1TET2MAPTHPGD
SCHEMBL2474496 0.69 ALDH1A1 (0.43) ALDH1A1MAPTHPGDRECQLKEAP1
SCHEMBL28347468 0.69 L3MBTL1 (0.31) ALDH1A1L3MBTL1
SCHEMBL10377692 0.67 ALDH1A1 (0.41) ALDH1A1MAPTHPGDRECQLKEAP1
SCHEMBL10971698 0.65 ALDH1A1 (0.39) ALDH1A1MAPTHPGDRECQLKEAP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0916674-B1 Purine derivatives having cyclopropane ring SUMIKA FINE CHEMICALS CO LTD (JP) 2002-05-08 EP disclosed
US-6342603-B1 PREPARING CYCLOPROPANE RING-CLEAVED PURINE DERIVATIVE BY HYDROGENATING PURINE DERIVATIVE HAVING CYCLOPROPANE RING SUMIKA FINE CHEMICALS CO., LTD. (JP) 2002-01-29 US disclosed
US-6156892-A Purine derivatives having cyclopropane ring SUMIKA FIRE CHEMICALS CO., LTD. (JP) 2000-12-05 US disclosed
EP-0916674-A1 Purine derivatives having cyclopropane ring SUMIKA FINE CHEMICALS Co., Ltd. (JP) 1999-05-19 EP disclosed
EP-0033863-A1 Process for the production of cis-bicyclo (3.3.0)octane-3,7-dione, and its use MERCK PATENT GmbH (DE) 1981-08-19 EP disclosed