Mandelic Acid

Mandelic Acid

SCHEMBL388417

C1N2CN3CN1CN(C2)C3.O=C(O)C(O)c1ccccc1.[SrH2]

nearest known ligand 0.72

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 5/20 0.72
MAPK1 P28482 1/20 0.72
SRC P12931 2/20 0.50
CES2 O00748 1/20 0.48
CES1 P23141 1/20 0.48
CYP2D6 P10635 2/20 0.45
HPGD P15428 1/20 0.44
GAA P10253 2/20 0.41
CYP2C9 P11712 1/20 0.40
HSD17B10 Q99714 1/20 0.40
BLM P54132 2/20 0.39
CHRM2 P08172 1/20 0.39
CHRM4 P08173 1/20 0.39
CHRM5 P08912 1/20 0.39
CHRM1 P11229 1/20 0.39
CHRM3 P20309 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
TDP1 Q9NUW8 1/20 0.39
KDM4E B2RXH2 1/20 0.39
ALDH1A1 P00352 1/20 0.39

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 SCHEMBL9747772 0.98 LMNA (0.75) LMNAMAPK1SRCCES2CES1
Mandelic Acid SCHEMBL3645 0.98 LMNA (0.75) LMNAMAPK1SRCCES2CES1
Mandelic Acid SCHEMBL3934174 0.87 LMNA (0.95) LMNAMAPK1SRCCES2CES1
Mandelic Acid SCHEMBL3934178 0.87 LMNA (0.95) LMNAMAPK1SRCCES2CES1
Mandelic Acid SCHEMBL165161 0.85 LMNA (1.00) LMNAMAPK1SRCCES2CES1
Mandelic Acid SCHEMBL21647917 0.85 LMNA (1.00) LMNAMAPK1SRCCES2CES1
Mandelic Acid SCHEMBL29777368 0.85 LMNA (1.00) LMNAMAPK1SRCCES2CES1
Mandelic Acid SCHEMBL5313046 0.85 LMNA (1.00) LMNAMAPK1SRCCES2CES1
Mandelic Acid SCHEMBL255601 0.85 LMNA (1.00) LMNAMAPK1SRCCES2CES1
Mandelic Acid SCHEMBL1050 0.85 LMNA (1.00) LMNAMAPK1SRCCES2CES1

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 47 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10092542-B2 Methods of using (+)-2-[1-(3-ethoxy-4-methoxyphenyl)-2-methylsulfonylethyl]-4-acetylaminoisoindoline-1,3-dione CELGENE CORPORATION (US) 2018-10-09 US claimed
US-20170281597-A1 METHODS OF USING (+)-2-[1-(3-ETHOXY-4-METHOXYPHENYL)-2-METHYLSULFONYLETHYL]-4-ACETYLAMINOISOINDOLINE-1,3-DIONE AMGEN INC. 2017-10-05 US claimed
US-20150290171-A1 METHODS FOR THE TREATMENT OF BONE LOSS CELGENE CORPORATION 2015-10-15 US claimed
EP-2916869-A1 METHODS FOR THE TREATMENT OF BONE LOSS Celgene Corporation (US) 2015-09-16 EP claimed
WO-2014074846-A1 METHODS FOR THE TREATMENT OF BONE LOSS CELGENE CORPORATION (US) 2014-05-15 WO claimed
EP-2097137-B1 COMPOSITIONS COMPRISING STRONTIUM AND USES THEREOF IN THE TREATMENT OR PREVENTION OF GINGIVITIS, PERIODONTITIS, PERIODONTITIS AS A MANIFESTATION OF SYSTEMIC DISEASES, AND NECROTIZING PERIODONTAL DISEASES. MOKWALO SPF S A (LU) 2012-09-19 EP claimed
US-8101564-B2 Methods for regulating osteoclast differentiation and bone resorption using LRRc17 TRUSTEES OF THE UNIVERSITY OF PENNSYLVANIA (US) 2012-01-24 US claimed
US-7576053-B2 treating osteoporosis caused by imbalance of osteoclast and osteoblast activity, glandular disorders with a Syk kinase inhibitor a 2,4-pyrimidinediamine compound; alendronate, calcitonin, estrogen and selective estrogen receptor modulators; side effect reduction RIGEL PHARMACEUTICALS, INC. (US) 2009-08-18 US claimed
US-20090104203-A1 Compositions and Methods for Regulating Osteoclast Differentiation, Activation and Bone Resorption TRUSTEES OF THE UNIVERSITY OF PENNSYLVANIA 2009-04-23 US claimed
EP-1896134-A2 METHODS AND COMPOSITIONS FOR TREATING DEGENERATIVE BONE DISORDERS Rigel Pharmaceuticals, Inc. (US) 2008-03-12 EP claimed
WO-2007130619-A1 COMPOSITIONS AND METHODS FOR REGULATING OSTEOCLAST DIFFERENTIATION, ACTIVATION AND BONE RESORPTION THE TRUSTEES OF THE UNIVERSITY OF PENNSYLVANIA (US) 2007-11-15 WO claimed
US-20070004626-A1 Methods and compositions for treating degenerative bone disorders RIGEL PHARMACEUTICALS, INC. (US) 2007-01-04 US claimed
WO-2006135915-A2 METHODS AND COMPOSITIONS FOR TREATING DEGENERATIVE BONE DISORDERS RIGEL PHARMACEUTICALS, INC. (US) 2006-12-21 WO claimed
US-10149824-B2 Reverse hexagonal mesophases (HII) and uses thereof YISSUM RESEARCH DEVELOPMENT COMPANY OF THE HEBREW UNIVERSITY OF JERUSALEM LTD. (IL) 2018-12-11 US disclosed
US-20180327354-A1 Unnatural Analogues of Calcitriol and Uses Thereof VIDASYM, LLC 2018-11-15 US disclosed
EP-2498754-B1 REVERSE HEXAGONAL MESOPHASES (H II) AND USES THEREOF YISSUM RES DEV CO OF HEBREW UNIV JERUSALEM LTD (IL) 2018-06-06 EP disclosed
US-20070004626-A1 Methods and compositions for treating degenerative bone disorders RIGEL PHARMACEUTICALS, INC. (US) 2007-01-04 US disclosed
CN-1887294-A Orally taken liquid medicine composition containing strontium HENAN FUREN PHARMACEUTICAL IND (CN) 2007-01-03 CN disclosed
WO-2006135915-A2 METHODS AND COMPOSITIONS FOR TREATING DEGENERATIVE BONE DISORDERS RIGEL PHARMACEUTICALS, INC. (US) 2006-12-21 WO disclosed
CN-1858049-A Synthetic method for strotium renelate intermediate UNIV HEBEI MEDICAL (CN) 2006-11-08 CN 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 (5 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-20170281597-A1 METHODS OF USING (+)-2-[1-(3-ETHOXY-4-METHOXYPHENYL)-2-METHYLSULFONYLETHYL]-4-ACETYLAMINOISOINDOLINE-1,3-DIONE PDE4A, PDE2A, PDE4B LMNA 1944/4885MAPK1 1206/4885SRC 4455/4885
US-20180327354-A1 Unnatural Analogues of Calcitriol and Uses Thereof VDR, CYP2R1, CYP24A1 LMNA 3373/4885MAPK1 1618/4885SRC 2259/4885
US-20150290171-A1 METHODS FOR THE TREATMENT OF BONE LOSS SOST, COL2A1, BMP2 LMNA 606/4885MAPK1 2442/4885SRC 2321/4885
US-20070004626-A1 Methods and compositions for treating degenerative bone disorders SYK, TRAF6, BTK LMNA 1133/4885MAPK1 911/4885SRC 16/4885
US-10092542-B2 Methods of using (+)-2-[1-(3-ethoxy-4-methoxyphenyl)-2-methylsulfonylethyl]-4-acetylaminoisoindoline-1,3-dione PDE4A, PDE2A, PDE4B LMNA 1944/4885MAPK1 1206/4885SRC 4455/4885

“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.