Phenylacetic Acid

Phenylacetic Acid

SCHEMBL1835502

COCCNCCOC.O=C(O)Cc1ccccc1

nearest known ligand 0.59

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
AKR1B1 P15121 1/20 0.59
KDM4E B2RXH2 7/20 0.51
LMNA P02545 4/20 0.49
ALDH1A1 P00352 2/20 0.49
MAPK1 P28482 1/20 0.49
MAPK8 P45983 1/20 0.48
MAPK10 P53779 1/20 0.48
MEN1 O00255 2/20 0.48
KMT2A Q03164 2/20 0.48
NPC1 O15118 1/20 0.48
HPGD P15428 2/20 0.47
ABCC4 O15439 1/20 0.47
GAA P10253 1/20 0.47
TSHR P16473 1/20 0.47
PTGS1 P23219 1/20 0.47
HTT P42858 1/20 0.47
ALOX15 P16050 1/20 0.47
LTA4H P09960 1/20 0.47
L3MBTL1 Q9Y468 2/20 0.46
ADRB2 P07550 1/20 0.46

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
Phenylacetic Acid SCHEMBL5550380 0.97 KDM4E (0.56) AKR1B1KDM4ELMNAALDH1A1MAPK1
SCHEMBL5550382 0.84 KDM4E (0.47) KDM4ELMNAALDH1A1MAPK1MAPK8
SCHEMBL11247636 0.84 KDM4E (0.60) KDM4ELMNAALDH1A1MAPK8MAPK10
Oxalic Acid SCHEMBL5523774 0.81 KMT2A (0.51) KDM4ELMNAALDH1A1MAPK1MEN1
SCHEMBL8059053 0.80 KDM4E (0.46) AKR1B1KDM4ELMNAALDH1A1MAPK1
SCHEMBL12500219 0.79 KDM4E (0.71) KDM4ELMNAALDH1A1MAPK1MAPK8
Benzoic Acid SCHEMBL1832943 0.79 HPGD (0.58) KDM4EALDH1A1MAPK1MEN1KMT2A
Phthalic Acid SCHEMBL1836759 0.79 MAPK1 (0.64) KDM4EALDH1A1MAPK1MEN1KMT2A
Phenylacetic Acid SCHEMBL27482425 0.78 AKR1B1 (0.68) AKR1B1KDM4ELMNAALDH1A1MAPK1
Phenylacetic Acid SCHEMBL1832667 0.78 AKR1B1 (0.68) AKR1B1LMNAMEN1KMT2ANPC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20070185330-A1 Liquids THE UNIVERSITY OF YORK (GB) 2007-08-09 US claimed
US-9328220-B2 Liquids INNOVIA FILMS LIMITED (GB) 2016-05-03 US disclosed
US-8992798-B2 Liquids INNOVIA FILMS LIMITED (GB) 2015-03-31 US disclosed
US-8784686-B2 Liquids INNOVIA FILMS LIMITED (GB) 2014-07-22 US disclosed
US-20140187684-A1 LIQUIDS INNOVIA FILMS LIMITED (GB) 2014-07-03 US disclosed
US-20110257433-A1 LIQUIDS THE UNIVERSITY OF YORK (GB) 2011-10-20 US disclosed
EP-2322497-A1 Ionic liquids comprising nitrogen containing cations Innovia Films Limited (GB) 2011-05-18 EP disclosed
US-20080221361-A1 Ionic Liquids BIONIQS LIMITED (GB) 2008-09-11 US disclosed
US-20070185330-A1 Liquids THE UNIVERSITY OF YORK (GB) 2007-08-09 US disclosed