SCHEMBL11487481

SCHEMBL11487481

CC1=Cc2ccccc2C(O)(C2CCN(C)CC2)c2ccsc21

nearest known ligand 0.56

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 1/20 0.56
SMN1; SMN2 Q16637 2/20 0.52
MAPK1 P28482 1/20 0.52
DRD2 P14416 4/20 0.33
DRD4 P21917 4/20 0.33
ACHE P22303 1/20 0.32
CHRM2 P08172 2/20 0.30
CHRM4 P08173 2/20 0.30
CHRM5 P08912 2/20 0.30
CHRM1 P11229 2/20 0.30
CHRM3 P20309 2/20 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
SCHEMBL11609680 0.85 L3MBTL1 (0.53) L3MBTL1SMN1; SMN2MAPK1DRD2DRD4
SCHEMBL9444177 0.78 L3MBTL1 (0.57) L3MBTL1SMN1; SMN2MAPK1DRD2ACHE
Hydrochloric Acid SCHEMBL9444156 0.77 L3MBTL1 (0.56) L3MBTL1SMN1; SMN2MAPK1DRD2ACHE
SCHEMBL9485683 0.74 L3MBTL1 (0.68) L3MBTL1SMN1; SMN2MAPK1DRD2DRD4
SCHEMBL9485715 0.73 L3MBTL1 (0.51) L3MBTL1SMN1; SMN2MAPK1
SCHEMBL11608316 0.72 L3MBTL1 (0.43) L3MBTL1SMN1; SMN2MAPK1DRD2DRD4
SCHEMBL11675386 0.71 L3MBTL1 (0.58) L3MBTL1SMN1; SMN2MAPK1CHRM2CHRM4
SCHEMBL9444141 0.71 L3MBTL1 (0.58) L3MBTL1SMN1; SMN2MAPK1CHRM2CHRM4
SCHEMBL9486504 0.71 L3MBTL1 (0.49) L3MBTL1SMN1; SMN2MAPK1DRD2ACHE
SCHEMBL11615421 0.71 L3MBTL1 (0.42) L3MBTL1SMN1; SMN2MAPK1DRD2DRD4

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
US-4223035-A ANTIDEPRESSANT, ANTICHOLINERGIC, HORMONE INHIBITOR SANDOZ LTD. (CH) 1980-09-16 US disclosed