SCHEMBL7937594

SCHEMBL7937594

O=C(O)c1ccccc1Cl.O=C(OCc1ccccc1)c1cccc(Cl)c1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 4/20 0.55
KMT2A Q03164 3/20 0.55
SLC6A2 P23975 1/20 0.55
SLC6A3 Q01959 1/20 0.55
ALDH1A1 P00352 7/20 0.55
RAB9A P51151 5/20 0.53
L3MBTL1 Q9Y468 3/20 0.52
CYP1A2 P05177 1/20 0.52
CYP3A4 P08684 1/20 0.52
CYP2C9 P11712 1/20 0.52
CYP2C19 P33261 1/20 0.52
NPSR1 Q6W5P4 1/20 0.52
NPC1 O15118 4/20 0.51
SMN1; SMN2 Q16637 4/20 0.51
KDM4E B2RXH2 1/20 0.51
BCHE P06276 1/20 0.50
LMNA P02545 4/20 0.48
HTT P42858 1/20 0.47
POLB P06746 1/20 0.47
MAPT P10636 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
SCHEMBL6057083 0.89 TDP1 (0.69) TDP1KMT2ASLC6A2SLC6A3ALDH1A1
SCHEMBL10613764 0.88 TDP1 (0.67) TDP1KMT2ASLC6A2SLC6A3ALDH1A1
SCHEMBL7945291 0.85 KMT2A (0.59) TDP1KMT2ASLC6A2SLC6A3ALDH1A1
SCHEMBL7946901 0.84 LMNA (0.56) KMT2AALDH1A1L3MBTL1NPC1SMN1; SMN2
SCHEMBL7946864 0.83 ALDH1A1 (0.73) TDP1KMT2ASLC6A2SLC6A3ALDH1A1
SCHEMBL7943878 0.82 ALDH1A1 (0.51) KMT2AALDH1A1RAB9AL3MBTL1NPSR1
SCHEMBL11563518 0.80 ALDH1A1 (0.66) KMT2AALDH1A1RAB9AL3MBTL1NPC1
SCHEMBL7945280 0.80 TSHR (0.54) TDP1KMT2AALDH1A1L3MBTL1CYP3A4
SCHEMBL27636542 0.79 KMT2A (0.67) TDP1KMT2ASLC6A2SLC6A3ALDH1A1
SCHEMBL6057150 0.79 ALDH1A1 (0.69) TDP1KMT2ASLC6A2SLC6A3ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2001051526-A1 PROCATALYSTS COMPRISING BIDENTATE LIGANDS, CATALYST SYSTEMS, AND USE IN OLEFIN POLYMERIZATION EASTMAN CHEMICAL COMPANY (US) 2001-07-19 WO disclosed
WO-2001051527-A1 PROCATALYSTS, CATALYST SYSTEMS, AND USE IN OLEFIN POLYMERIZATION EASTMAN CHEMICAL COMPANY (US) 2001-07-19 WO disclosed
WO-2001051529-A1 PROCATALYSTS COMPRISING BIDENTATE LIGANDS, CATALYST SYSTEMS, AND USE IN OLEFIN POLYMERIZATION EASTMAN CHEMICAL COMPANY (US) 2001-07-19 WO disclosed
WO-2001051528-A1 PROCATALYSTS COMPRISING BIDENTATE LIGANDS, CATALYST SYSTEMS, AND USE IN OLEFIN POLYMERIZATION EASTMAN CHEMICAL COMPANY (US) 2001-07-19 WO disclosed