Phenylacetic Acid

Phenylacetic Acid

SCHEMBL3034419

CCCC[n+]1ccn(C)c1.O=C([O-])Cc1ccccc1

nearest known ligand 0.41

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Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 2/20 0.38
▸ MAPT P10636 1/20 0.38
▸ HTT P42858 1/20 0.38
▸ SMN1; SMN2 Q16637 1/20 0.38
▸ PABPC1 P11940 1/20 0.38
▸ KDM4E B2RXH2 1/20 0.38
▸ HPGD P15428 1/20 0.38
▸ CNR2 P34972 3/20 0.37
▸ MEN1 O00255 2/20 0.37
▸ KMT2A Q03164 2/20 0.37
▸ EEF2K O00418 2/20 0.37
▸ EEF2 P13639 2/20 0.37
▸ PLK4 O00444 1/20 0.37
▸ JAK2 O60674 1/20 0.37
▸ EGFR P00533 1/20 0.37
▸ TYK2 P29597 1/20 0.37
▸ FLT3 P36888 1/20 0.37
▸ BLM P54132 1/20 0.37
▸ ITK Q08881 1/20 0.37
▸ PIM2 Q9P1W9 1/20 0.37

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 SCHEMBL3039200 0.89 HDAC3 (0.43) ALDH1A1MAPTHTTSMN1; SMN2PABPC1
Benzoic Acid SCHEMBL3848714 0.86 CA2 (0.41) ALDH1A1MAPTHTTSMN1; SMN2PABPC1
Benzoic Acid SCHEMBL3031636 0.86 CA2 (0.41) ALDH1A1MAPTHTTSMN1; SMN2PABPC1
Bicarbonate SCHEMBL2127090 0.85 MEN1 (0.40) SMN1; SMN2PABPC1MEN1KMT2A
Naphthalene SCHEMBL28400409 0.84 HTT (0.41) ALDH1A1MAPTHTTSMN1; SMN2PABPC1
Phthalic Acid SCHEMBL29142295 0.84 ALDH1A1 (0.37) ALDH1A1MAPTHTTSMN1; SMN2PABPC1
Propionic Acid SCHEMBL358643 0.83 MEN1 (0.39) SMN1; SMN2PABPC1MEN1KMT2A
Bicarbonate SCHEMBL5032083 0.83 MEN1 (0.41) SMN1; SMN2PABPC1MEN1KMT2A
SCHEMBL3039455 0.83 TDP1 (0.43) ALDH1A1MAPTHTTSMN1; SMN2PABPC1
Benzoic Acid SCHEMBL3848711 0.82 KDM4E (0.39) ALDH1A1MAPTHTTSMN1; SMN2PABPC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8591757-B2 Electrolyte composition and ionic liquid KANEKA CORPORATION (JP) 2013-11-26 — — US disclosed
US-20100213402-A1 ELECTROLYTE COMPOSITION AND IONIC LIQUID KANEKA CORPORATION (JP) 2010-08-26 — — US disclosed
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