Phenyl Propionic Acid

Phenyl Propionic Acid

SCHEMBL28549079

COC(=O)CCc1cccc(OC)c1.O=C(O)CCc1ccccc1

nearest known ligand 0.60

Full drug profile on Sugi Atlas →

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ RAB9A P51151 2/20 0.60
▸ FFAR1 O14842 8/20 0.59
▸ GAA P10253 1/20 0.57
▸ CYP1A2 P05177 1/20 0.55
▸ PLA2G4A P47712 1/20 0.55
▸ HDAC1 Q13547 1/20 0.53
▸ HDAC6 Q9UBN7 1/20 0.53
▸ FFAR4 Q5NUL3 2/20 0.53
▸ GNA15 P30679 1/20 0.53
▸ PTGER3 P43115 1/20 0.53
▸ TDP1 Q9NUW8 1/20 0.53
▸ ALDH1A1 P00352 1/20 0.53
▸ KEAP1 Q14145 1/20 0.53
▸ MTNR1A P48039 1/20 0.52
▸ MTNR1B P49286 1/20 0.52
▸ NPC1 O15118 1/20 0.51

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 SCHEMBL28910944 0.99 RAB9A (0.59) RAB9AFFAR1GAACYP1A2PLA2G4A
SCHEMBL63100 0.91 HDAC1 (0.61) RAB9ACYP1A2HDAC1HDAC6MTNR1A
SCHEMBL346302 0.90 FFAR1 (0.65) RAB9AFFAR1GAACYP1A2PLA2G4A
Phenyl Propionic Acid SCHEMBL28541991 0.88 FFAR1 (0.57) FFAR1GAAPLA2G4AFFAR4GNA15
Methyl 3-Phenylpropanoate SCHEMBL213543 0.87 KEAP1 (0.70) FFAR1HDAC1HDAC6FFAR4TDP1
Phenyl Propionic Acid SCHEMBL28543757 0.86 LMNA (0.59) RAB9AFFAR1GAAPLA2G4AFFAR4
Methyl 3-Phenylpropanoate SCHEMBL27506579 0.85 KEAP1 (0.68) FFAR1HDAC1HDAC6FFAR4TDP1
Methyl 3-Phenylpropanoate SCHEMBL6734679 0.85 KEAP1 (0.68) FFAR1HDAC1HDAC6FFAR4TDP1
Phenyl Propionic Acid SCHEMBL28554549 0.85 FFAR1 (0.60) FFAR1FFAR4
Phenyl Propionic Acid SCHEMBL28551157 0.84 FFAR4 (0.57) RAB9AFFAR1CYP1A2FFAR4TDP1

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
CN-109438238-B Synthetic method of dihydrocinnamate compound 陕西师范大学 2021-04-13 — — CN disclosed
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