Phenyl Propionic Acid

Phenyl Propionic Acid

SCHEMBL6534962

O=C([O-])CCc1ccccc1.O=C([O-])CCc1ccccc1.[Mg+2]

nearest known ligand 0.70

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

ATP4AATP4BGABBR1GABBR2HMGCR

The experimentally established mechanism targets of Phenyl Propionic Acid. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HDAC1 Q13547 5/20 0.70
HDAC2 Q92769 3/20 0.70
HDAC8 Q9BY41 3/20 0.70
HDAC6 Q9UBN7 3/20 0.70
HDAC3 O15379 2/20 0.70
HDAC4 P56524 2/20 0.70
HDAC7 Q8WUI4 2/20 0.70
HDAC10 Q969S8 2/20 0.70
HDAC11 Q96DB2 2/20 0.70
HDAC9 Q9UKV0 2/20 0.70
HDAC5 Q9UQL6 2/20 0.70
KEAP1 Q14145 1/20 0.64
ALDH1A1 P00352 2/20 0.59
FFAR1 O14842 2/20 0.59
TDP1 Q9NUW8 3/20 0.55
MAPK1 P28482 1/20 0.54
ADRA1A P35348 1/20 0.54
SLC6A3 Q01959 1/20 0.54
SMN1; SMN2 Q16637 1/20 0.54
PLAAT5 Q96KN8 1/20 0.53

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
Phenyl Propionic Acid SCHEMBL9385376 0.95 HDAC1 (0.77) HDAC1HDAC2HDAC8HDAC6HDAC3
Phenyl Propionic Acid SCHEMBL14715904 0.95 HDAC1 (0.70) HDAC1HDAC2HDAC8HDAC6HDAC3
Phenyl Propionic Acid SCHEMBL6672575 0.95 HDAC1 (0.77) HDAC1HDAC2HDAC8HDAC6HDAC3
Phenyl Propionic Acid SCHEMBL7736260 0.95 HDAC1 (0.70) HDAC1HDAC2HDAC8HDAC6HDAC3
Phenyl Propionic Acid SCHEMBL5351804 0.95 HDAC1 (0.70) HDAC1HDAC2HDAC8HDAC6HDAC3
Phenyl Propionic Acid SCHEMBL11668372 0.95 HDAC1 (0.70) HDAC1HDAC2HDAC8HDAC6HDAC3
Phenyl Propionic Acid SCHEMBL9175294 0.95 HDAC1 (0.70) HDAC1HDAC2HDAC8HDAC6HDAC3
Phenyl Propionic Acid SCHEMBL10878200 0.95 HDAC1 (0.70) HDAC1HDAC2HDAC8HDAC6HDAC3
Phenyl Propionic Acid SCHEMBL5351527 0.95 HDAC1 (0.70) HDAC1HDAC2HDAC8HDAC6HDAC3
Phenyl Propionic Acid SCHEMBL376109 0.95 HDAC1 (0.70) HDAC1HDAC2HDAC8HDAC6HDAC3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20220169603-A1 NOVEL SALTS, CRYSTALLINE FORMS AND PREMIX OF HYPOLIPIDEMIC AGENT ZYDUS LIFESCIENCES LIMITED (IN) 2022-06-02 US disclosed
EP-2670486-A1 TREATMENT FOR LIPODYSTROPHY Cadila Healthcare Limited (IN) 2013-12-11 EP disclosed
WO-2012104869-A1 TREATMENT FOR LIPODYSTROPHY CADILA HEALTHCARE LIMITED (IN) 2012-08-09 WO disclosed
EP-0957919-A4 ANALGESIC COMPOSITION FOR TREATMENT OF MIGRAINE HEADACHES MAUSKOP ALEXANDER (US) 2004-07-28 EP disclosed
EP-1436268-A1 BENZOXAZINE AND BENZOTHIAZINE DERIVATIVES AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM Dr. Reddy's Laboratories Ltd. (IN) 2004-07-14 EP disclosed
WO-2003033481-A1 BENZOXAZINE AND BENZOTHIAZINE DERIVATIVES AND PARMACEUTICAL COMPOSITIONS CONTAINING THEM DR. REDDY'S LABORATORIES LTD. (IN) 2003-04-24 WO disclosed
EP-0957919-A1 ANALGESIC COMPOSITION FOR TREATMENT OF MIGRAINE HEADACHES Mauskop, Alexander (US) 1999-11-24 EP disclosed
US-5914129-A MAGNESIUM SALT, STIMULANT, EFFERVESCING AGENT AND CARRIERS MAUSKOP ALEXANDER (US) 1999-06-22 US disclosed
WO-1998003179-A1 ANALGESIC COMPOSITION FOR TREATMENT OF MIGRAINE HEADACHES MAUSKOP ALEXANDER (US) 1998-01-29 WO disclosed
US-5538959-A RAPID ABSORPTION, MAGNESIUM SALT MAUSKOP ALEXANDER (US) 1996-07-23 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-20220169603-A1 NOVEL SALTS, CRYSTALLINE FORMS AND PREMIX OF HYPOLIPIDEMIC AGENT SLC5A1, SLC5A2, GBA3 HDAC1 1092/4885HDAC2 1190/4885HDAC8 1707/4885

“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.