SCHEMBL5608583

SCHEMBL5608583

CC(C)OC(=O)C1OC1C1CCCCC1

nearest known ligand 0.33

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.33
MAPT P10636 1/20 0.33
AHCY P23526 1/20 0.32
TSHR P16473 2/20 0.31
CA12 O43570 2/20 0.31
CA1 P00915 2/20 0.31
CA2 P00918 2/20 0.31
MMP2 P08253 2/20 0.31
CA9 Q16790 2/20 0.31
EPHX1 P07099 1/20 0.31
ATM Q13315 1/20 0.30
HPGD P15428 1/20 0.30
NPSR1 Q6W5P4 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
SCHEMBL5608543 0.81 SMN1; SMN2 (0.39) ALDH1A1TSHRCA12CA1CA2
SCHEMBL5608576 0.77 GAA (0.36) EPHX1HPGDNPSR1
SCHEMBL5608908 0.77 ALDH1A1 (0.43) ALDH1A1MAPTTSHRATMHPGD
SCHEMBL5608730 0.76 EPHX1 (0.39) CA12CA1CA2CA9EPHX1
SCHEMBL5608930 0.75 PPM1B (0.45) ALDH1A1MAPTHPGD
SCHEMBL1170184 0.72 TSHR (0.39) TSHRCA12CA1CA2MMP2
SCHEMBL1421696 0.72 SMN1; SMN2 (0.44) ALDH1A1TSHREPHX1
SCHEMBL10260369 0.72 SMN1; SMN2 (0.44) ALDH1A1TSHREPHX1
SCHEMBL10260332 0.72 SMN1; SMN2 (0.44) ALDH1A1TSHREPHX1
SCHEMBL5194126 0.72 SUCNR1 (0.42) ALDH1A1TSHR

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-7169944-B2 Optically active epoxy compounds and processes for their production TOSOH CORPORATION (JP) 2007-01-30 US disclosed
US-20040063979-A1 Optically active epoxy compounds and processes for their production TOSOH CORPORATION (JP) 2004-04-01 US disclosed
EP-1403260-A2 Optically active epoxy compounds and processes for their production Tosoh Corporation (JP) 2004-03-31 EP 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-20040063979-A1 Optically active epoxy compounds and processes for their production CYP51A1, CYP11B1, PTGES ALDH1A1 349/4885MAPT 4136/4885AHCY 4558/4885

“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.