SCHEMBL8734591

SCHEMBL8734591

CC(=O)OOc1nc(Cl)c(Cl)cc1Cl

nearest known ligand 0.44

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 2/20 0.44
MEN1 O00255 1/20 0.44
KMT2A Q03164 1/20 0.44
ALDH1A1 P00352 2/20 0.41
MAPK1 P28482 2/20 0.41
CYP3A4 P08684 1/20 0.41
MAPT P10636 1/20 0.41
ALOX15 P16050 1/20 0.41
TSHR P16473 1/20 0.41
ALOX12 P18054 1/20 0.41
ATM Q13315 1/20 0.41
HSD17B10 Q99714 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.30

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
SCHEMBL6058682 0.81 TDP1 (0.50) TDP1MEN1KMT2AALDH1A1MAPK1
SCHEMBL32670815 0.75 TDP1 (0.41) TDP1MEN1KMT2AALDH1A1MAPK1
SCHEMBL12786974 0.74 TDP1 (0.43) TDP1MEN1KMT2AALDH1A1MAPK1
SCHEMBL10999122 0.72 TDP1 (0.47) TDP1MEN1KMT2AALDH1A1MAPK1
SCHEMBL10749607 0.71 KMT2A (0.51) TDP1MEN1KMT2AALDH1A1MAPK1
Triclopyr SCHEMBL23633000 0.71 KDM4E (0.45) TDP1MEN1KMT2AALDH1A1MAPK1
SCHEMBL31254099 0.70 TDP1 (0.58) TDP1MEN1KMT2AALDH1A1MAPK1
SCHEMBL11749341 0.70 TDP1 (0.58) TDP1MEN1KMT2AALDH1A1MAPK1
SCHEMBL5461728 0.69 LMNA (0.46) TDP1MEN1KMT2AALDH1A1MAPK1
Triclopyr SCHEMBL28421277 0.69 KDM4E (0.43) TDP1MEN1KMT2AALDH1A1MAPK1

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
EP-0814662-A1 MIXED HERBICIDAL COMPOSITIONS DOWELANCO LIMITED (US) 1998-01-07 EP claimed
WO-1996028027-A1 MIXED HERBICIDAL COMPOSITIONS DOWELANCO (US) 1996-09-19 WO claimed
EP-0814662-A1 MIXED HERBICIDAL COMPOSITIONS DOWELANCO LIMITED (US) 1998-01-07 EP disclosed
WO-1996028027-A1 MIXED HERBICIDAL COMPOSITIONS DOWELANCO (US) 1996-09-19 WO disclosed