SCHEMBL5492210

SCHEMBL5492210

CCOC(=O)c1ccccc1C(=O)O.COCCOC

nearest known ligand 0.70

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
TSHR P16473 7/20 0.70
ALDH1A1 P00352 6/20 0.56
HSD17B10 Q99714 2/20 0.56
TDP1 Q9NUW8 2/20 0.53
L3MBTL1 Q9Y468 2/20 0.53
KDM4E B2RXH2 1/20 0.52
MAPK1 P28482 3/20 0.51
CYP3A4 P08684 2/20 0.51
TP53 P04637 1/20 0.51
CDC25B P30305 1/20 0.51
POLB P06746 1/20 0.50
MAPT P10636 1/20 0.50
LMNA P02545 1/20 0.50
HTT P42858 1/20 0.48
KMT2A Q03164 1/20 0.48
SMN1; SMN2 Q16637 1/20 0.47
ALOX15 P16050 1/20 0.47

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
Diethyl Phthalate SCHEMBL5492207 0.93 TSHR (0.81) TSHRALDH1A1HSD17B10TDP1L3MBTL1
Phthalic Acid SCHEMBL6234815 0.91 TSHR (0.84) TSHRALDH1A1HSD17B10TDP1L3MBTL1
Diethyl Phthalate SCHEMBL2697040 0.91 TSHR (0.84) TSHRALDH1A1HSD17B10TDP1L3MBTL1
SCHEMBL29628800 0.91 TSHR (0.84) TSHRALDH1A1HSD17B10TDP1L3MBTL1
SCHEMBL50234 0.91 TSHR (0.84) TSHRALDH1A1HSD17B10TDP1L3MBTL1
Diethyl Phthalate SCHEMBL9132522 0.91 TSHR (0.84) TSHRALDH1A1HSD17B10TDP1L3MBTL1
Diethyl Phthalate SCHEMBL28274022 0.91 TSHR (0.84) TSHRALDH1A1HSD17B10TDP1L3MBTL1
Phthalic Acid SCHEMBL9132525 0.91 TSHR (0.84) TSHRALDH1A1HSD17B10TDP1L3MBTL1
SCHEMBL186286 0.90 TSHR (0.86) TSHRALDH1A1HSD17B10TDP1L3MBTL1
Hydrochloric Acid SCHEMBL10634124 0.90 TSHR (0.81) TSHRALDH1A1HSD17B10TDP1L3MBTL1

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
WO-2007062198-A1 METHODS TO ACCELERATE THE ISOLATION OF NOVEL CELL STRAINS FROM PLURIPOTENT STEM CELLS AND CELLS OBTAINED THEREBY ADVANCED CELL TECHNOLOGY, INC. (US) 2007-05-31 WO disclosed