Mandelic Acid

Mandelic Acid

SCHEMBL2010439

COc1cccc(C(C)N)c1.O=C(O)[C@@H](O)c1ccccc1

nearest known ligand 0.52

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 1/20 0.52
LMNA P02545 2/20 0.51
MAPK1 P28482 1/20 0.51
PTGS1 P23219 1/20 0.49
TRPM8 Q7Z2W7 2/20 0.48
MTNR1A P48039 2/20 0.47
MTNR1B P49286 2/20 0.47
AOC3 Q16853 2/20 0.47
CASR P41180 1/20 0.45
HTR1A P08908 1/20 0.44
ADRA2A P08913 1/20 0.44
DRD1 P21728 1/20 0.44
SLC6A2 P23975 1/20 0.44
SLC6A4 P31645 1/20 0.44
ADRA1A P35348 1/20 0.44
OPRM1 P35372 1/20 0.44
DRD3 P35462 1/20 0.44
SLC6A3 Q01959 1/20 0.44
KCNH2 Q12809 1/20 0.44
GPR139 Q6DWJ6 1/20 0.44

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
SCHEMBL6400603 0.86 L3MBTL1 (0.58) L3MBTL1LMNAMAPK1PTGS1MTNR1A
SCHEMBL503788 0.86 L3MBTL1 (0.58) L3MBTL1LMNAMAPK1PTGS1MTNR1A
SCHEMBL503789 0.86 L3MBTL1 (0.58) L3MBTL1LMNAMAPK1PTGS1MTNR1A
Mandelic Acid SCHEMBL4873771 0.83 ACHE (0.57) LMNAMAPK1TRPM8
Mandelic Acid SCHEMBL2436177 0.83 ACHE (0.57) LMNAMAPK1TRPM8
SCHEMBL135107 0.83 TAAR1 (0.56) L3MBTL1AOC3CASR
SCHEMBL335349 0.83 TAAR1 (0.56) L3MBTL1AOC3CASR
SCHEMBL335622 0.83 TAAR1 (0.56) L3MBTL1AOC3CASR
SCHEMBL29676707 0.83 TAAR1 (0.56) L3MBTL1AOC3CASR
SCHEMBL29350839 0.83 TAAR1 (0.56) L3MBTL1AOC3CASR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20110230666-A1 PROCESS FOR THE SEPARATION OF ENANTIOMERICALLY PURE COMPOUNDS SHODHANA LABORATORIES LIMITED (IN) 2011-09-22 US disclosed
WO-2011070585-A1 PROCESSES FOR PREPARING RIVASTIGMINE, SALTS AND INTERMEDIATES THEREOF SHODHANA LABORATORIES LIMITED (IN) 2011-06-16 WO 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-20110230666-A1 PROCESS FOR THE SEPARATION OF ENANTIOMERICALLY PURE COMPOUNDS HTR5A, ACHE, CHRNA5 L3MBTL1 4233/4885LMNA 2205/4885MAPK1 3122/4885

“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.