SCHEMBL4848165

SCHEMBL4848165

[CH2]CC(=O)OCCOCCOCC

nearest known ligand 0.56

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 6/20 0.56
TSHR P16473 3/20 0.56
THRB P10828 2/20 0.53
TP53 P04637 2/20 0.40
HIF1A Q16665 2/20 0.40
HSD17B10 Q99714 2/20 0.40
EPHX2 P34913 2/20 0.38
DGKA P23743 1/20 0.38
MGAM O43451 1/20 0.36
GAA P10253 1/20 0.36
SI P14410 1/20 0.36
MGAM2 Q2M2H8 1/20 0.36
NAAA Q02083 1/20 0.33
TRPA1 O75762 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33

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
SCHEMBL4853279 0.98 ALDH1A1 (0.58) ALDH1A1TSHRTHRBTP53HIF1A
SCHEMBL8195672 0.87 DGKA (0.42) ALDH1A1TSHRTHRBTP53HIF1A
SCHEMBL4849689 0.83 ALDH1A1 (0.52) ALDH1A1TSHRTHRBTP53HIF1A
SCHEMBL8896001 0.83 DGKA (0.48) ALDH1A1TSHRTHRBTP53HIF1A
SCHEMBL8894704 0.83 DGKA (0.48) ALDH1A1TSHRTHRBTP53HIF1A
SCHEMBL4856244 0.83 TSHR (0.40) ALDH1A1TSHRTHRBTP53HIF1A
SCHEMBL3879046 0.82 ALDH1A1 (0.60) ALDH1A1TSHRTHRBTP53HIF1A
SCHEMBL181390 0.82 ALDH1A1 (0.60) ALDH1A1TSHRTHRBTP53HIF1A
SCHEMBL2303872 0.82 ALDH1A1 (0.60) ALDH1A1TSHRTHRBTP53HIF1A
SCHEMBL5411907 0.82 ALDH1A1 (0.60) ALDH1A1TSHRTHRBTP53HIF1A

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
US-7329694-B2 Ocular lens JOHNSON & JOHNSON VISION CARE, INC. (US) 2008-02-12 US disclosed
EP-1445641-B1 OCULAR LENS JOHNSON & JOHNSON VISION CARE (US) 2007-10-03 EP disclosed
US-20040201820-A1 Ocular lens JOHNSON & JOHNSON VISION CARE, INC. 2004-10-14 US disclosed
US-20040198938-A1 Monomers, polymers and ophthalmic lenses JOHNSON & JOHNSON VISION CARE, INC. 2004-10-07 US disclosed
EP-1445641-A1 OCULAR LENS Johnson & Johnson Vision Care, Inc. (US) 2004-08-11 EP disclosed
EP-1424339-A1 MONOMERS, POLYMERS AND OPHTHALMIC LENSES Johson & Johnson Vision Care Inc. (US) 2004-06-02 EP disclosed
US-4211696-A Disperse monoazo dyestuffs derived from 3,5-dinitro-2-amino thiophene as disazo component and an arylamine coupling component IMPERIAL CHEMICAL INDUSTRIES LIMITED (GB) 1980-07-08 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20040198938-A1 Monomers, polymers and ophthalmic lenses LOXL1, CRYAA, UACA ALDH1A1 1939/4885TSHR 4300/4885THRB 3917/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.