SCHEMBL5397382

SCHEMBL5397382

CCCCOOC(=O)C(C)(O)CC.CCCCOOC(=O)C(C)(O)CC.[Zr]

nearest known ligand 0.36

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.36
ATM Q13315 1/20 0.34
TSHR P16473 2/20 0.32
HPGD P15428 1/20 0.32
HCAR2 Q8TDS4 1/20 0.31
MEN1 O00255 1/20 0.30
KMT2A Q03164 1/20 0.30
CES2 O00748 1/20 0.30
TDP1 Q9NUW8 1/20 0.30
L3MBTL1 Q9Y468 1/20 0.30

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
SCHEMBL7710037 0.80 ALDH1A1 (0.41) ALDH1A1ATMTSHRHPGDHCAR2
SCHEMBL7653360 0.79 ALDH1A1 (0.50) ALDH1A1ATMTSHRHPGDHCAR2
SCHEMBL4676913 0.79 ALDH1A1 (0.40) ALDH1A1ATMTSHRHPGDHCAR2
SCHEMBL31022719 0.76 ALDH1A1 (0.39) ALDH1A1ATMTSHRHPGDHCAR2
SCHEMBL6324614 0.76 ALDH1A1 (0.39) ALDH1A1ATMTSHRHPGDHCAR2
SCHEMBL4941852 0.76 CYP4F2 (0.41) ALDH1A1ATMTSHRHPGDHCAR2
SCHEMBL29362775 0.75 NAAA (0.41) ALDH1A1TSHRHCAR2CES2
SCHEMBL7760739 0.74 ALDH1A1 (0.36) ALDH1A1ATMTSHRHPGDHCAR2
SCHEMBL28323030 0.74 ALDH1A1 (0.36) ALDH1A1ATMTSHRHPGDHCAR2
SCHEMBL27570686 0.74 ALDH1A1 (0.41) ALDH1A1ATMTSHRHPGDHCAR2

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
US-7213915-B2 Ink jet printer and image recording method KONICA MINOLTA HOLDINGS, INC. (JP) 2007-05-08 US disclosed
US-20040141041-A1 Ink jet printer and image recording method KONICA MINOLTA HOLDINGS, INC. (JP) 2004-07-22 US disclosed
EP-1428667-A2 Ink jet printer and image recording method KONICA MINOLTA HOLDINGS, INC. (JP) 2004-06-16 EP disclosed
US-4444862-A Electrophotographic photosensitive materials having layer of organic metal compound FUJI XEROX CO., LTD. (JP) 1984-04-24 US disclosed