SCHEMBL9859653

SCHEMBL9859653

Cc1cc(Br)ccc1Oc1ccc(S(=O)(=O)c2ccc(Oc3ccc(Br)cc3C)cc2)cc1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTT P42858 2/20 0.46
SMN1; SMN2 Q16637 1/20 0.46
TDP1 Q9NUW8 1/20 0.45
L3MBTL1 Q9Y468 1/20 0.45
PKM P14618 4/20 0.43
PTPN1 P18031 1/20 0.42
RAPGEF4 Q8WZA2 1/20 0.41
EPAS1 Q99814 2/20 0.40
PTGS2 P35354 2/20 0.40
PTGS1 P23219 1/20 0.40
POLB P06746 2/20 0.40
TSHR P16473 2/20 0.40
MAPK1 P28482 1/20 0.40
ALDH1A1 P00352 2/20 0.39
HPGD P15428 1/20 0.39
NPSR1 Q6W5P4 1/20 0.39
MAPT P10636 1/20 0.39
GAA P10253 2/20 0.38
PGR P06401 1/20 0.38
SLC6A2 P23975 1/20 0.38

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
SCHEMBL11292165 0.95 HTT (0.49) HTTSMN1; SMN2TDP1L3MBTL1PKM
SCHEMBL11299921 0.93 PKM (0.50) HTTSMN1; SMN2TDP1L3MBTL1PKM
SCHEMBL11301461 0.92 HTT (0.49) HTTSMN1; SMN2TDP1L3MBTL1PKM
SCHEMBL11295332 0.92 HTT (0.46) HTTSMN1; SMN2TDP1L3MBTL1PKM
SCHEMBL11296514 0.89 HTT (0.47) HTTSMN1; SMN2TDP1L3MBTL1PKM
SCHEMBL11293471 0.88 HTT (0.46) HTTSMN1; SMN2TDP1L3MBTL1PKM
SCHEMBL11297458 0.88 HTT (0.43) HTTSMN1; SMN2TDP1L3MBTL1PKM
SCHEMBL11297725 0.87 HTT (0.48) HTTSMN1; SMN2TDP1L3MBTL1PKM
SCHEMBL11302564 0.87 HTT (0.45) HTTSMN1; SMN2TDP1L3MBTL1PKM
SCHEMBL11299945 0.85 HTT (0.49) HTTSMN1; SMN2TDP1L3MBTL1PKM

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0446720-A2 Novel brominated phenoxy compounds and processes for their preparation Bromine Compounds Ltd. (IL) 1991-09-18 EP disclosed