SCHEMBL17068328

SCHEMBL17068328

CC1=C(OCc2ccccc2)[C@@H](C2COC(=O)O2)OC1=O

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.37
GAA P10253 1/20 0.37
MAOB P27338 5/20 0.37
MAOA P21397 3/20 0.37
GRM2 Q14416 1/20 0.36
NPC1 O15118 1/20 0.36
ALDH1A1 P00352 1/20 0.36
HPGD P15428 1/20 0.36
NFKB1 P19838 1/20 0.36
GRM5 P41594 1/20 0.36
RAB9A P51151 1/20 0.36
NFKB2 Q00653 1/20 0.36
RELA Q04206 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
NPSR1 Q6W5P4 1/20 0.36
HPSE Q9Y251 1/20 0.35
MAPT P10636 2/20 0.35
MAPK1 P28482 1/20 0.35
TDP1 Q9NUW8 1/20 0.35
L3MBTL1 Q9Y468 1/20 0.35

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
SCHEMBL16950216 0.87 MAOB (0.39) LMNAMAOBMAOAGRM2NPC1
SCHEMBL17068318 0.79 TMEM97 (0.36) LMNAGAAMAOBMAOAGRM2
SCHEMBL17068337 0.79 TMEM97 (0.36) LMNAGAAMAOBMAOAGRM2
SCHEMBL22494053 0.72 HPSE (0.39) LMNAGAAMAOBMAOAGRM2
SCHEMBL14372169 0.72 HPSE (0.39) LMNAGAAMAOBMAOAGRM2
SCHEMBL17068324 0.69 HPSE (0.47) LMNAGAAMAOBGRM2HPSE
SCHEMBL17068325 0.68 HPSE (0.43) LMNAGAAMAOBALDH1A1HPGD
SCHEMBL17068348 0.68 TAAR1 (0.41) LMNAGAAMAOBGRM2NPC1
SCHEMBL13013398 0.68 TMEM97 (0.37) LMNAGAAMAOBMAOAGRM2
SCHEMBL10703049 0.68 TMEM97 (0.37) LMNAGAAMAOBMAOAGRM2

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 LMNA 4569/4885GAA 2766/4885MAOB 3396/4885

“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.