SCHEMBL8155209

SCHEMBL8155209

[c]1ccc(C2NCCS2)cc1

nearest known ligand 0.61

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.61
TDP1 Q9NUW8 2/20 0.61
SMN1; SMN2 Q16637 1/20 0.61
ALDH1A1 P00352 1/20 0.56
ERN1 O75460 1/20 0.33

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
SCHEMBL4655299 0.79 MAPT (0.66) MAPTTDP1SMN1; SMN2ALDH1A1
SCHEMBL2084173 0.77 MAPT (0.62) MAPTTDP1SMN1; SMN2ALDH1A1
SCHEMBL4153725 0.76 MAPT (0.61) MAPTTDP1SMN1; SMN2ALDH1A1ERN1
SCHEMBL2082827 0.76 MAPT (1.00) MAPTTDP1SMN1; SMN2ALDH1A1ERN1
Bicarbonate SCHEMBL9826841 0.73 MAPT (0.58) MAPTTDP1SMN1; SMN2ALDH1A1
SCHEMBL8193763 0.73 MAPT (0.41) MAPTTDP1SMN1; SMN2ALDH1A1
SCHEMBL4924273 0.72 ALDH1A1 (1.00) MAPTTDP1SMN1; SMN2ALDH1A1ERN1
SCHEMBL2084131 0.72 MAPT (0.66) MAPTTDP1SMN1; SMN2ALDH1A1ERN1
SCHEMBL28022020 0.69 MAPT (0.57) MAPTTDP1SMN1; SMN2ALDH1A1
SCHEMBL3213057 0.69 MAOA (0.58) MAPTTDP1SMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-1188404-C Cyclic compound FUJISAWA PHARMACEUTICAL CO (JP) 2005-02-09 CN disclosed
CN-1425010-A Cyclic compound FUJISAWA PHARMACEUTICAL CO (JP) 2003-06-18 CN disclosed
US-6093733-A FOR THE TREATMENT OR PREVENTION OF DISEASES THE TREATMENT OR PREVENTION OF WHICH IS MEDIATED BY MUSCARINIC RECEPTOR AGONISM; ALZHEIMER'S DISEASE PFIZER INC. 2000-07-25 US disclosed