Phenyl Propionic Acid

Phenyl Propionic Acid

SCHEMBL7528837

COC(=O)CCc1cccc(Br)c1Br.O=C(O)CCc1ccccc1

nearest known ligand 0.52

Full drug profile on Sugi Atlas →

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
FFAR1 O14842 8/20 0.52
FFAR4 Q5NUL3 5/20 0.52
KEAP1 Q14145 1/20 0.50
TDP1 Q9NUW8 2/20 0.46
THRA P10827 3/20 0.45
THRB P10828 3/20 0.45
CA12 O43570 1/20 0.45
CA7 P43166 1/20 0.45
CA9 Q16790 1/20 0.45
CA14 Q9ULX7 1/20 0.45
PTGER1 P34995 1/20 0.43
PTGER4 P35408 1/20 0.43
PTGER3 P43115 1/20 0.43
PTGER2 P43116 1/20 0.43
PPARG P37231 1/20 0.42

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
Methyl 3-Phenylpropanoate SCHEMBL213543 0.84 KEAP1 (0.70) FFAR1FFAR4KEAP1TDP1CA12
Methyl 3-Phenylpropanoate SCHEMBL6734679 0.83 KEAP1 (0.68) FFAR1FFAR4KEAP1TDP1CA12
Methyl 3-Phenylpropanoate SCHEMBL27506579 0.83 KEAP1 (0.68) FFAR1FFAR4KEAP1TDP1CA12
SCHEMBL4641301 0.83 FFAR1 (0.49) FFAR1FFAR4KEAP1THRATHRB
Phenyl Propionic Acid SCHEMBL28549085 0.80 FFAR1 (0.59) FFAR1FFAR4KEAP1TDP1THRA
Methyl 3-Phenylpropanoate SCHEMBL7106668 0.80 KEAP1 (0.63) FFAR1FFAR4KEAP1TDP1CA12
SCHEMBL6757 0.80 TAAR1 (0.50) FFAR1FFAR4TDP1
Methyl 3-Phenylpropanoate SCHEMBL168711 0.80 TDP1 (0.68) FFAR1KEAP1TDP1CA12CA7
Methyl 3-Phenylpropanoate SCHEMBL1893702 0.78 TDP1 (0.66) FFAR1KEAP1TDP1CA12CA7
Methyl 3-Phenylpropanoate SCHEMBL27315471 0.78 TDP1 (0.66) FFAR1KEAP1TDP1CA12CA7

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
WO-2002015691-A1 USE FOR CONIFER SAPLING PROTECTION AGAINST INSECT ATTACK ROBIGUS AB (SE) 2002-02-28 WO disclosed