SCHEMBL9505665

SCHEMBL9505665

O=C(COC(=O)c1ccccc1)OO

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 3/20 0.57
ALDH1A1 P00352 3/20 0.56
L3MBTL1 Q9Y468 2/20 0.56
KDM4E B2RXH2 2/20 0.56
GAA P10253 2/20 0.56
KMT2A Q03164 2/20 0.55
MAPK1 P28482 1/20 0.55
HIF1A Q16665 1/20 0.55
SLC6A2 P23975 1/20 0.55
SLC6A3 Q01959 1/20 0.55
RAB9A P51151 3/20 0.54
NPC1 O15118 2/20 0.54
HPGD P15428 2/20 0.54
LMNA P02545 2/20 0.53
CYP1A2 P05177 1/20 0.53
CYP2C9 P11712 1/20 0.53
CYP2C19 P33261 1/20 0.53
SMN1; SMN2 Q16637 2/20 0.51
NFKB1 P19838 1/20 0.51
NFKB2 Q00653 1/20 0.51

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
SCHEMBL8773117 0.84 TDP1 (0.57) TDP1ALDH1A1L3MBTL1KDM4EGAA
SCHEMBL6311599 0.82 TSHR (0.61) TDP1ALDH1A1L3MBTL1KDM4EGAA
SCHEMBL194520 0.81 TDP1 (0.63) TDP1ALDH1A1L3MBTL1KDM4EGAA
SCHEMBL582352 0.81 TDP1 (0.63) TDP1ALDH1A1L3MBTL1KDM4EGAA
SCHEMBL4586692 0.81 TDP1 (0.63) TDP1ALDH1A1L3MBTL1KDM4EGAA
SCHEMBL13445453 0.81 NPC1 (0.60) TDP1ALDH1A1L3MBTL1KDM4EGAA
SCHEMBL23754766 0.79 LMNA (0.58) TDP1ALDH1A1L3MBTL1KDM4EGAA
SCHEMBL6662121 0.79 KMT2A (0.76) TDP1ALDH1A1L3MBTL1KDM4EGAA
SCHEMBL83331 0.79 RAB9A (0.79) TDP1ALDH1A1L3MBTL1KDM4EGAA
Potassium SCHEMBL31360984 0.79 TDP1 (0.61) TDP1ALDH1A1L3MBTL1KDM4EGAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0267047-B1 BLEACHING COMPOSITIONS, GLYCOLATE ESTER PERACIDS AND PRECURSORS The Clorox Company (US) 1993-08-04 EP claimed
US-4959187-A Glycolate ester peracid precursors THE CLOROX COMPANY (US) 1990-09-25 US claimed
EP-0267047-A2 Bleaching compositions, glycolate ester peracids and precursors The Clorox Company (US) 1988-05-11 EP claimed
EP-0267047-B1 BLEACHING COMPOSITIONS, GLYCOLATE ESTER PERACIDS AND PRECURSORS The Clorox Company (US) 1993-08-04 EP disclosed
US-4959187-A Glycolate ester peracid precursors THE CLOROX COMPANY (US) 1990-09-25 US disclosed
US-4778618-A AND SOURCE OF HYDROGEN PEROXIDE; BLEACHING TEXTILES OVER NIDE TEMPERATURE RANGE THE CLOROX COMPANY (US) 1988-10-18 US disclosed
EP-0267047-A2 Bleaching compositions, glycolate ester peracids and precursors The Clorox Company (US) 1988-05-11 EP disclosed