SCHEMBL16673237

SCHEMBL16673237

CCCOC(=O)CCOc1ccccc1

nearest known ligand 0.58

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.58
MAPT P10636 3/20 0.58
POLB P06746 2/20 0.53
LMNA P02545 2/20 0.53
HTT P42858 1/20 0.52
CYP1A2 P05177 1/20 0.51
CYP3A4 P08684 1/20 0.51
CYP2C9 P11712 1/20 0.51
CYP2C19 P33261 1/20 0.51
TDP1 Q9NUW8 2/20 0.51
KMT2A Q03164 3/20 0.51
MEN1 O00255 2/20 0.51
F2 P00734 1/20 0.51
TP53 P04637 1/20 0.50
HPGD P15428 1/20 0.50
LTA4H P09960 1/20 0.50

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
SCHEMBL16673223 0.91 TDP1 (0.57) ALDH1A1MAPTPOLBLMNATDP1
SCHEMBL7647369 0.90 LTA4H (0.61) ALDH1A1POLBLMNAHTTTDP1
SCHEMBL38664 0.89 LTA4H (0.60) ALDH1A1MAPTPOLBTDP1LTA4H
SCHEMBL187624 0.88 LTA4H (0.60) ALDH1A1LMNACYP3A4TP53LTA4H
SCHEMBL28264158 0.87 LTA4H (0.58) ALDH1A1LMNAHTTTP53LTA4H
SCHEMBL4563082 0.86 ALOX15 (0.55) ALDH1A1MAPTPOLBLMNAHTT
SCHEMBL3640377 0.86 THRB (0.56) ALDH1A1MAPTLMNATDP1KMT2A
SCHEMBL11777851 0.84 L3MBTL1 (0.64) MAPTLMNATDP1KMT2AMEN1
SCHEMBL1396777 0.84 ALDH1A1 (0.64) ALDH1A1MAPTPOLBLMNACYP1A2
SCHEMBL21834924 0.83 LTA4H (0.56) MAPTPOLBTDP1LTA4H

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-118164921-A Propyl phenoxypropionate compound, preparation method thereof and application thereof as herbicide 山东德瑞克化工科技有限公司 2024-06-11 CN claimed
CN-118164921-A Propyl phenoxypropionate compound, preparation method thereof and application thereof as herbicide 山东德瑞克化工科技有限公司 2024-06-11 CN disclosed
CN-118164921-A Propyl phenoxypropionate compound, preparation method thereof and application thereof as herbicide 山东德瑞克化工科技有限公司 2024-06-11 CN disclosed
CN-118164921-A Propyl phenoxypropionate compound, preparation method thereof and application thereof as herbicide 山东德瑞克化工科技有限公司 2024-06-11 CN disclosed
EP-2869389-B1 NONAQUEOUS ELECTROLYTIC SOLUTION AND NONAQUEOUS ELECTROLYTIC SOLUTION CELL USING SAME MITSUBISHI CHEM CORP (JP) 2019-11-13 EP disclosed
US-10320030-B2 Nonaqueous electrolyte solution and nonaqueous electrolyte battery employing the same MITSUBISHI CHEMICAL CORPORATION (JP) 2019-06-11 US disclosed
US-20150140448-A1 NONAQUEOUS ELECTROLYTE SOLUTION AND NONAQUEOUS ELECTROLYTE BATTERY EMPLOYING THE SAME MITSUBISHI CHEMICAL CORPORATION (JP) 2015-05-21 US disclosed
EP-2869389-A1 NONAQUEOUS ELECTROLYTIC SOLUTION AND NONAQUEOUS ELECTROLYTIC SOLUTION CELL USING SAME Mitsubishi Chemical Corporation (JP) 2015-05-06 EP disclosed