SCHEMBL7524253

SCHEMBL7524253

O=C(O)CC(C=C(Cl)Cl)c1cc(Cl)ccc1Cl

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MME P08473 1/20 0.40
MEN1 O00255 3/20 0.39
KMT2A Q03164 3/20 0.39
L3MBTL1 Q9Y468 1/20 0.39
EEF2K O00418 1/20 0.39
ALDH1A1 P00352 1/20 0.39
TP53 P04637 1/20 0.39
FFAR1 O14842 1/20 0.36
RECQL P46063 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
GABBR2 O75899 3/20 0.36
GABBR1 Q9UBS5 3/20 0.36
LMNA P02545 2/20 0.36
CYP3A4 P08684 2/20 0.36
CYP1A2 P05177 2/20 0.36
CYP2C9 P11712 2/20 0.36
TDP1 Q9NUW8 1/20 0.36
ADORA3 P0DMS8 1/20 0.36
NFKB1 P19838 1/20 0.36
DRD3 P35462 1/20 0.36

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
SCHEMBL7522036 0.88 EEF2K (0.44) EEF2KFFAR1RECQLSMN1; SMN2TDP1
SCHEMBL7522018 0.82 ALDH1A1 (0.41) MEN1KMT2AL3MBTL1EEF2KALDH1A1
SCHEMBL6581667 0.79 GABBR2 (0.51) MMEMEN1KMT2AL3MBTL1ALDH1A1
SCHEMBL7522581 0.77 ALDH1A1 (0.43) ALDH1A1FFAR1SMN1; SMN2LMNA
SCHEMBL7522886 0.76 MEN1 (0.47) MEN1KMT2AALDH1A1LMNACYP3A4
SCHEMBL14580268 0.74 MEN1 (0.45) MMEMEN1KMT2AL3MBTL1ALDH1A1
SCHEMBL17755252 0.74 FFAR1 (0.52) MMEMEN1KMT2AL3MBTL1EEF2K
SCHEMBL7519215 0.73 AKR1B1 (0.42) KMT2AALDH1A1CYP1A2TSHRFEN1
SCHEMBL7527581 0.72 SMN1; SMN2 (0.42) MEN1KMT2AL3MBTL1ALDH1A1FFAR1
SCHEMBL7528033 0.72 CTSA (0.42) FFAR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1181267-A1 HALOGEN COMPOUNDS Bayer Aktiengesellschaft (DE) 2002-02-27 EP disclosed
WO-2000071500-A1 HALOGEN COMPOUNDS BAYER AKTIENGESELLSCHAFT (DE) 2000-11-30 WO disclosed