Mandelic Acid

Mandelic Acid

SCHEMBL7700968

CC1CCCNC1.O=C(O)C(O)c1ccccc1

nearest known ligand 0.51

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Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
LMNA P02545 3/20 0.51
MAPK1 P28482 1/20 0.51
KMT2A Q03164 1/20 0.41
SLC6A2 P23975 1/20 0.39
SLC6A4 P31645 1/20 0.39
SLC6A3 Q01959 1/20 0.39
KDM4E B2RXH2 1/20 0.38
JAK3 P52333 1/20 0.38
NR1I2 O75469 1/20 0.38
ABCB11 O95342 1/20 0.38

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
Mandelic Acid SCHEMBL738154 1.00 LMNA (0.51) LMNAMAPK1KMT2ASLC6A2SLC6A4
Mandelic Acid SCHEMBL738480 1.00 LMNA (0.51) LMNAMAPK1KMT2ASLC6A2SLC6A4
Mandelic Acid SCHEMBL738482 1.00 LMNA (0.51) LMNAMAPK1KMT2ASLC6A2SLC6A4
Mandelic Acid SCHEMBL7703006 1.00 LMNA (0.51) LMNAMAPK1KMT2ASLC6A2SLC6A4
SCHEMBL1995231 0.86 PTGS2 (0.45)
Mandelic Acid SCHEMBL522946 0.83 LMNA (0.64) LMNAMAPK1SLC6A2SLC6A4SLC6A3
Mandelic Acid SCHEMBL9618665 0.79 LMNA (0.55) LMNAMAPK1KMT2ASLC6A2SLC6A4
Mandelic Acid SCHEMBL6950424 0.79 KMT2A (0.49) LMNAMAPK1KMT2A
Mandelic Acid SCHEMBL27837822 0.78 LMNA (0.67) LMNAMAPK1KMT2ASLC6A2SLC6A4
Mandelic Acid SCHEMBL16278854 0.77 LMNA (0.55) LMNAMAPK1SLC6A2SLC6A4SLC6A3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-101258138-A Phenoxypropylpiperidines and -pyrrolidines and their use as histamine h3-receptor ligands BIOPROJET SOC CIV (FR) 2008-09-03 CN disclosed
US-6342511-B1 RACEMIC, ENANTIOMORPHS AND DIASTERIOMORPHS SOCIETE DE CONSEILS DE RECHERCHES ET D'APPLICATIONS SCIENTIFIQUES (S.C.R.A.S.) (FR) 2002-01-29 US disclosed
EP-0986555-A1 NOVEL PHENCYCLIDINE DERIVATIVES, PREPARATION METHODS AND PHARMACEUTICAL COMPOSITIONS CONTAINING SAME SOCIETE DE CONSEILS DE RECHERCHES ET D'APPLICATIONS SCIENTIFIQUES (S.C.R.A.S.) (FR) 2000-03-22 EP disclosed
WO-1998055478-A1 NOVEL PHENCYCLIDINE DERIVATIVES, PREPARATION METHODS AND PHARMACEUTICAL COMPOSITIONS CONTAINING SAME SOCIETE DE CONSEILS DE RECHERCHES ET D'APPLICATIONS SCIENTIFIQUES (S.C.R.A.S.) (FR) 1998-12-10 WO disclosed