SCHEMBL1471743

SCHEMBL1471743

CCCCCC(C(=O)O)c1ccc[nH]1

nearest known ligand 0.42

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
CPB2 Q96IY4 4/20 0.42
CPB1 P15086 1/20 0.41
GPR84 Q9NQS5 3/20 0.40
FFAR1 O14842 1/20 0.40
CNR2 P34972 1/20 0.39
MAPT P10636 1/20 0.39
LCK P06239 1/20 0.39
PPARD Q03181 1/20 0.39
ZDHHC20 Q5W0Z9 1/20 0.39
ZDHHC2 Q9UIJ5 1/20 0.39
ALDH1A1 P00352 1/20 0.37
ACE2 Q9BYF1 1/20 0.37
LMNA P02545 1/20 0.35
GRIK1 P39086 1/20 0.35
SLC1A2 P43004 1/20 0.35
SLC1A1 P43005 1/20 0.35
GRIK2 Q13002 1/20 0.35
CES2 O00748 1/20 0.35
CES1 P23141 1/20 0.35

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
SCHEMBL2927175 0.98 CPB2 (0.43) CPB2CPB1GPR84FFAR1CNR2
SCHEMBL10367905 0.90 CNR2 (0.38) GPR84FFAR1CNR2MAPTLCK
SCHEMBL7260977 0.82 AKR1C3 (0.37) MAPTLMNA
SCHEMBL10513500 0.80 CPB2 (0.36) CPB2CPB1MAPTALDH1A1
SCHEMBL4722745 0.80 CSNK1E (0.36) GPR84CNR2ALDH1A1
SCHEMBL5694337 0.78 CSNK1E (0.38) GPR84FFAR1CNR2ALDH1A1
SCHEMBL3639685 0.77 CSNK1E (0.31)
SCHEMBL21101056 0.76 NR1I2 (0.38) GPR84ALDH1A1LMNA
SCHEMBL22819103 0.76 NR1I2 (0.38) GPR84ALDH1A1LMNA
SCHEMBL3637539 0.76 EP300 (0.31)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7915302-B2 Crystal forms of pyrrolylheptanoic acid derivatives DONG-A PHARM. CO., LTD. (KR) 2011-03-29 US disclosed
CN-101657419-A Novel crystal form of pyrrolylheptanoic acid derivative DONG A PHARM CO LTD KR 2010-02-24 CN disclosed
WO-2009084827-A3 SYNTHETIC INTERMEDIATES, PROCESS FOR PREPARING PYRROLYLHEPTANOIC ACID DERIVATIVES THEREFROM DONG-A PHARM.CO., LTD. (KR) 2009-08-27 WO disclosed
WO-2009084827-A2 SYNTHETIC INTERMEDIATES, PROCESS FOR PREPARING PYRROLYLHEPTANOIC ACID DERIVATIVES THEREFROM DONG-A PHARM.CO., LTD. (KR) 2009-07-09 WO disclosed
WO-2009084827-A2 SYNTHETIC INTERMEDIATES, PROCESS FOR PREPARING PYRROLYLHEPTANOIC ACID DERIVATIVES THEREFROM DONG-A PHARM.CO., LTD. (KR) 2009-07-09 WO disclosed