SCHEMBL17068337

SCHEMBL17068337

CC1=C(OCc2ccccc2)C(C2COC(C)(C)O2)OC1=O

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TMEM97 Q5BJF2 2/20 0.36
SIGMAR1 Q99720 2/20 0.36
LMNA P02545 1/20 0.35
GAA P10253 1/20 0.35
TP53 P04637 1/20 0.35
OPRM1 P35372 1/20 0.35
OPRD1 P41143 1/20 0.35
MAOB P27338 2/20 0.34
GRM2 Q14416 1/20 0.34
CTSV O60911 1/20 0.34
CTSL P07711 1/20 0.34
CTSB P07858 1/20 0.34
CTSS P25774 1/20 0.34
CTSK P43235 1/20 0.34
CTSC P53634 1/20 0.34
CTSF Q9UBX1 1/20 0.34
ALDH1A1 P00352 1/20 0.34
NPSR1 Q6W5P4 1/20 0.34
HPSE Q9Y251 1/20 0.34
BRD4 O60885 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
SCHEMBL17068318 1.00 TMEM97 (0.36) TMEM97SIGMAR1LMNAGAATP53
SCHEMBL8539003 0.89 TMEM97 (0.37) TMEM97SIGMAR1LMNAGAATP53
SCHEMBL10703049 0.89 TMEM97 (0.37) TMEM97SIGMAR1LMNAGAATP53
SCHEMBL13013398 0.89 TMEM97 (0.37) TMEM97SIGMAR1LMNAGAATP53
SCHEMBL6851717 0.87 TMEM97 (0.38) TMEM97SIGMAR1TP53OPRM1OPRD1
SCHEMBL886854 0.87 TMEM97 (0.38) TMEM97SIGMAR1TP53OPRM1OPRD1
SCHEMBL12636660 0.84 GRM2 (0.37) TMEM97SIGMAR1LMNAGAATP53
SCHEMBL16950173 0.84 TMEM97 (0.38) TMEM97SIGMAR1TP53OPRM1OPRD1
SCHEMBL6853632 0.84 TMEM97 (0.36) TMEM97SIGMAR1LMNATP53OPRM1
SCHEMBL17063513 0.83 TMEM97 (0.38) TMEM97SIGMAR1MAOBALDH1A1HPSE

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
US-20150250169-A1 ASCORBIC ACID-RELATED COMPOUND AND PLANT ANTIVIRAL AGENT NIPPON SODA CO., LTD. (JP) 2015-09-10 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-20150250169-A1 ASCORBIC ACID-RELATED COMPOUND AND PLANT ANTIVIRAL AGENT CBR3, OSR1, OXSR1 TMEM97 3815/4885SIGMAR1 470/4885LMNA 4569/4885

“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.