SCHEMBL27290318

SCHEMBL27290318

Oc1cccc(Br)c1C1NCCS1

nearest known ligand 0.47

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.47
TDP1 Q9NUW8 2/20 0.47
SMN1; SMN2 Q16637 1/20 0.47
ERN1 O75460 1/20 0.40
ALDH1A1 P00352 1/20 0.37
KDM1A O60341 1/20 0.33
CHRNB2 P17787 1/20 0.32
CHRNA4 P43681 1/20 0.32

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
SCHEMBL30683724 0.88 MAPT (0.46) MAPTTDP1SMN1; SMN2ERN1ALDH1A1
SCHEMBL27296873 0.81 MAPT (0.47) MAPTTDP1SMN1; SMN2ERN1ALDH1A1
SCHEMBL27294881 0.74 MAPT (0.35) MAPTTDP1SMN1; SMN2ERN1ALDH1A1
SCHEMBL30683723 0.73 ERN1 (0.48) MAPTTDP1SMN1; SMN2ERN1ALDH1A1
SCHEMBL8951248 0.73 MAPT (0.44) MAPTTDP1SMN1; SMN2ERN1ALDH1A1
SCHEMBL11129658 0.72 MECP2 (0.49) MAPTTDP1SMN1; SMN2ERN1ALDH1A1
SCHEMBL12767256 0.72 MAPT (0.42) MAPTTDP1SMN1; SMN2ERN1ALDH1A1
SCHEMBL10791762 0.70 MAPT (0.46) MAPTTDP1SMN1; SMN2ERN1ALDH1A1
SCHEMBL2359691 0.67 CHRNB2 (0.39) TDP1ALDH1A1CHRNB2CHRNA4
SCHEMBL30683721 0.67 MAPT (0.50) MAPTTDP1SMN1; SMN2ERN1ALDH1A1

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
CN-1039492-C Herbicides ZENECA LTD (GB) 1998-08-12 CN disclosed
CN-1095066-A Weedicide ZENECA LTD (GB) 1994-11-16 CN disclosed