SCHEMBL4510397

SCHEMBL4510397

O=C(O)c1ccccc1C(=O)OCCSc1ccc2ccccc2c1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 5/20 0.48
▸ MCL1 Q07820 3/20 0.46
▸ BCL2A1 Q16548 3/20 0.46
▸ BCL2 P10415 1/20 0.46
▸ BCL2L1 Q07817 1/20 0.46
▸ ANPEP P15144 1/20 0.44
▸ TSHR P16473 5/20 0.43
▸ L3MBTL1 Q9Y468 3/20 0.42
▸ TDP1 Q9NUW8 2/20 0.42
▸ MAPK1 P28482 2/20 0.42
▸ CNR2 P34972 1/20 0.41
▸ MEN1 O00255 3/20 0.41
▸ KMT2A Q03164 3/20 0.41
▸ TP53 P04637 1/20 0.41
▸ CYP3A4 P08684 1/20 0.41
▸ NPC1 O15118 2/20 0.41
▸ RAB9A P51151 2/20 0.41
▸ SMN1; SMN2 Q16637 2/20 0.41
▸ HSP90AA1 P07900 1/20 0.41
▸ CASP3 P42574 1/20 0.40

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
SCHEMBL1286846 0.85 ALDH1A1 (0.56) ALDH1A1TSHRL3MBTL1TDP1MAPK1
SCHEMBL3302489 0.77 ALDH1A1 (0.69) ALDH1A1TSHRL3MBTL1TDP1MAPK1
SCHEMBL28492073 0.75 ALDH1A1 (0.67) ALDH1A1TSHRL3MBTL1TDP1MAPK1
SCHEMBL1491949 0.74 THRB (0.51) ALDH1A1ANPEPTSHRTDP1MAPK1
SCHEMBL5709795 0.73 TSHR (0.70) ALDH1A1TSHRL3MBTL1TDP1MAPK1
SCHEMBL27446307 0.73 TSHR (0.67) ALDH1A1TSHRL3MBTL1TDP1MAPK1
SCHEMBL27804362 0.73 ANPEP (0.46) ALDH1A1ANPEPTDP1CNR2CYP3A4
Naphthalene SCHEMBL27469240 0.72 TSHR (0.75) ALDH1A1TSHRL3MBTL1TDP1MAPK1
SCHEMBL3499810 0.72 PRNP (0.55) ALDH1A1MCL1BCL2A1BCL2BCL2L1
SCHEMBL1395556 0.72 ALDH1A1 (0.71) ALDH1A1TSHRL3MBTL1TDP1MAPK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7547467-B2 which are dispersed in acrylic polymer to enhance durability and/or refractive index; colloidal titania or zirconia; monophthalate ester (phthalic acid mono-(2-acryloxy-ethyl) ester); a monocarboxylic acid having oxyalkylene groups (2-(2-methoxyethoxy) acetic acid); flat panel displays 3M INNOVATIVE PROPERTIES COMPANY (US) 2009-06-16 — — US disclosed
WO-2007059228-A1 BRIGHTNESS ENHANCING FILM AND METHOD OF SURFACE TREATING INORGANIC NANOPARTICLES 3M INNOVATIVE PROPERTIES COMPANY (US) 2007-05-24 — — WO disclosed
US-20070112097-A1 BRIGHTNESS ENHANCING FILM AND METHODS OF SURFACE TREATING INORGANIC NANOPARTICLES 3M INNOVATIVE PROPERTIES COMPANY 2007-05-17 — — US disclosed
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