SCHEMBL1720153

SCHEMBL1720153

C=CC(C(=O)c1ccccc1)C(=O)c1ccccc1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
AKT1 P31749 1/20 0.52
LMNA P02545 4/20 0.50
TDP1 Q9NUW8 4/20 0.50
L3MBTL1 Q9Y468 2/20 0.50
CES1 P23141 4/20 0.48
CES2 O00748 3/20 0.48
MDM2 Q00987 1/20 0.45
ALDH1A1 P00352 4/20 0.44
TSHR P16473 2/20 0.44
DAO P14920 1/20 0.44
NAPRT Q6XQN6 1/20 0.44
MAPK1 P28482 2/20 0.43
ALKBH5 Q6P6C2 1/20 0.41
PGR P06401 1/20 0.41
ADRA2A P08913 1/20 0.41
ADRA2B P18089 1/20 0.41
HTR2A P28223 1/20 0.41
HRH1 P35367 1/20 0.41
KCNH2 Q12809 1/20 0.41
MAPT P10636 3/20 0.41

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
SCHEMBL6678865 0.91 AKT1 (0.48) AKT1LMNATDP1L3MBTL1CES1
SCHEMBL5369406 0.88 LMNA (0.49) AKT1LMNATDP1L3MBTL1CES1
Ammonia Solution, Strong SCHEMBL9507417 0.86 LMNA (0.47) AKT1LMNATDP1L3MBTL1CES1
SCHEMBL11287380 0.82 LMNA (0.54) AKT1LMNATDP1L3MBTL1CES1
SCHEMBL27624213 0.80 MEN1 (0.51) LMNATDP1ALDH1A1TSHRPGR
SCHEMBL45241 0.80 LMNA (0.52) AKT1LMNATDP1L3MBTL1CES1
SCHEMBL28060783 0.79 TDP1 (0.52) AKT1LMNATDP1L3MBTL1CES1
SCHEMBL45332 0.78 AKT1 (0.48) AKT1LMNATDP1L3MBTL1CES1
SCHEMBL10623103 0.78 AKT1 (0.48) AKT1LMNATDP1L3MBTL1CES1
SCHEMBL9093296 0.78 LMNA (0.51) AKT1LMNATDP1L3MBTL1CES1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20040265178-A1 Molecularly imprinted polymer solution anion sensor MURRAY GEORGE M (US) 2004-12-30 US claimed
EP-1436599-A2 MOLECULARLY IMPRINTED POLYMER SOLUTION ANION SENSOR The Johns Hopkins University (US) 2004-07-14 EP claimed
US-6749811-B2 QUANTITATIVE ANALYSIS; USING POLYMER BOUND TO RARE EARTH COMPOUND; WATER POLLUTION CONTROL THE JOHNS HOPKINS UNIVERSITY 2004-06-15 US claimed
US-20030129092-A1 Molecularly imprinted polymer solution anion sensor JOHN HOPKINS UNIVERSITY, THE 2003-07-10 US claimed
WO-2003034043-A2 MOLECULARLY IMPRINTED POLYMER SOLUTION ANION SENSOR THE JOHNS HOPKINS UNIVERSTIY (US) 2003-04-24 WO claimed
EP-1733211-B1 PROCESSABLE MOLECULARLY IMPRINTED POLYMERS UNIV JOHNS HOPKINS (US) 2012-01-11 EP disclosed
US-20040265178-A1 Molecularly imprinted polymer solution anion sensor MURRAY GEORGE M (US) 2004-12-30 US disclosed
EP-1436599-A2 MOLECULARLY IMPRINTED POLYMER SOLUTION ANION SENSOR The Johns Hopkins University (US) 2004-07-14 EP disclosed
US-6749811-B2 QUANTITATIVE ANALYSIS; USING POLYMER BOUND TO RARE EARTH COMPOUND; WATER POLLUTION CONTROL THE JOHNS HOPKINS UNIVERSITY 2004-06-15 US disclosed
US-20030129092-A1 Molecularly imprinted polymer solution anion sensor JOHN HOPKINS UNIVERSITY, THE 2003-07-10 US disclosed
WO-2003034043-A2 MOLECULARLY IMPRINTED POLYMER SOLUTION ANION SENSOR THE JOHNS HOPKINS UNIVERSTIY (US) 2003-04-24 WO disclosed
US-20030003587-A1 Molecularly imprinted polymer based sensors for the detection of narcotics JOHNS HOPKINS UNIVERSITY, THE 2003-01-02 US disclosed
WO-2001077672-A2 MOLECULARLY IMPRINTED POLYMER BASED SENSORS FOR THE DETECTION OF NARCOTICS THE JOHNS HOPKINS UNIVERSITY (US) 2001-10-18 WO disclosed