SCHEMBL28155258

SCHEMBL28155258

O=C(O)C(=O)Oc1ccccc1.[NaH]

nearest known ligand 0.48

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 2/20 0.48
ATM Q13315 2/20 0.48
L3MBTL1 Q9Y468 2/20 0.48
ALOX15 P16050 2/20 0.47
HSD17B10 Q99714 2/20 0.47
HPGD P15428 1/20 0.47
ELANE P08246 2/20 0.44
MAPT P10636 3/20 0.44
KDM4E B2RXH2 1/20 0.44
NSD2 O96028 1/20 0.44
ALDH1A1 P00352 4/20 0.41
CYP19A1 P11511 1/20 0.41
SMN1; SMN2 Q16637 2/20 0.41
RAB9A P51151 2/20 0.40
NPC1 O15118 1/20 0.40
RAD51 Q06609 1/20 0.40

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
SCHEMBL419381 0.97 TDP1 (0.50) TDP1ATML3MBTL1ALOX15HSD17B10
SCHEMBL28029898 0.95 TDP1 (0.48) TDP1ATML3MBTL1ALOX15HSD17B10
Oxalic Acid SCHEMBL28484395 0.95 TDP1 (0.48) TDP1ATML3MBTL1ALOX15HSD17B10
Acetic Acid SCHEMBL11560134 0.91 ELANE (0.50) TDP1ATML3MBTL1ALOX15HSD17B10
Phenol SCHEMBL27489897 0.89 TDP1 (0.48) TDP1ATML3MBTL1ALOX15HSD17B10
SCHEMBL27541467 0.89 TDP1 (0.44) TDP1ATML3MBTL1ALOX15HSD17B10
Chloroform SCHEMBL27542875 0.89 ATM (0.44) TDP1ATML3MBTL1ALOX15HSD17B10
Diphenyl Ethanedioat SCHEMBL10797780 0.87 TDP1 (0.50) TDP1ATML3MBTL1ALOX15HSD17B10
Diphenyl Ethanedioat SCHEMBL43364 0.87 TDP1 (0.54) TDP1ATML3MBTL1ALOX15HSD17B10
Trimethylammonium SCHEMBL27770043 0.87 MAPT (0.47) TDP1ATML3MBTL1ALOX15HSD17B10

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-107267310-A A kind of green natural compounded efficient fruits and vegetables washing salt of plant type 中原工学院 2017-10-20 CN claimed
CN-206915891-U Remove the processing system of phosphorus and nickel in chemical nickle-plating wastewater 深圳市世清环保科技有限公司 2018-01-23 CN disclosed
CN-106698764-A Method for removing phosphorus and nickel in electroless nickel-plating wastewater and treatment system 深圳市世清环保科技有限公司 2017-05-24 CN disclosed