SCHEMBL27316348

SCHEMBL27316348

N#CCCCC1=CC=Cc2ccccc2N1

nearest known ligand 0.43

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.43
GAA P10253 1/20 0.43
ATM Q13315 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
RAB9A P51151 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
MPO P05164 1/20 0.31
SLC6A4 P31645 1/20 0.31

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
SCHEMBL27287397 0.81 MAPT (0.44) MAPTGAARAB9ASMN1; SMN2
SCHEMBL4770305 0.80 GAA (0.47) MAPTGAA
SCHEMBL1246857 0.79 GAA (0.46) MAPTGAA
SCHEMBL9935465 0.73 MAPT (0.48) MAPTGAARAB9ASMN1; SMN2
SCHEMBL8334125 0.73 MAPT (0.48) MAPTGAARAB9ASMN1; SMN2
SCHEMBL8781958 0.73 MAPT (0.48) MAPTGAARAB9ASMN1; SMN2
SCHEMBL9536334 0.73 GAA (0.48) MAPTGAA
SCHEMBL27316259 0.70 MAPT (0.41) MAPTGAARAB9ASMN1; SMN2
SCHEMBL1247317 0.69 MAPT (0.48) MAPTGAARAB9ASMN1; SMN2
SCHEMBL11298721 0.69 GAA (0.44) MAPTGAA

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
CN-1038099-A Alpha-adrenergic aceptor antagonist SMITHKLINE BECKMAN CORP (US) 1989-12-20 CN disclosed