SCHEMBL6903463

SCHEMBL6903463

CN(C)C(=O)N1CCN2CCNCC2C1

nearest known ligand 0.46

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
HTR6 P50406 1/20 0.39
MAPT P10636 2/20 0.36
KMT2A Q03164 2/20 0.33
MEN1 O00255 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
HSD17B10 Q99714 1/20 0.32
IRAK4 Q9NWZ3 1/20 0.31
ACACB O00763 1/20 0.31
ACACA Q13085 1/20 0.31
HRH3 Q9Y5N1 1/20 0.31
GAA P10253 1/20 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
Hydrochloric Acid SCHEMBL6662100 0.85 HTR6 (0.37) HTR6
SCHEMBL13462187 0.82 CHRNB2 (0.43) HTR6SMN1; SMN2HRH3
SCHEMBL21039950 0.82 CHRNB2 (0.43) HTR6SMN1; SMN2HRH3
SCHEMBL28356121 0.80 HTR6 (0.43) HTR6HSD17B10HRH3
SCHEMBL31660918 0.75 USP2 (0.40) HTR6MAPTKMT2AMEN1SMN1; SMN2
SCHEMBL20523597 0.75 USP2 (0.40) HTR6MAPTKMT2AMEN1SMN1; SMN2
Trifluoroacetic Acid SCHEMBL20523513 0.74 CHRNB2 (0.36) HTR6
SCHEMBL24127421 0.71 MAPT (0.44) MAPTKMT2AMEN1SMN1; SMN2HSD17B10
SCHEMBL22608794 0.70 HTR6 (0.39) HTR6
SCHEMBL14826557 0.70 DPP4 (0.40) HTR6

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
JP-2004517873-A 2004-06-17 JP claimed
EP-1368343-A1 1-(2-METHOXYBENZYL)-3-BENZHYDRYLPIPERAZINES AS TACHYKININ ANTAGONISTS FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2003-12-10 EP claimed
WO-2002055518-A1 1-(2-METHOXYBENZYL)-3-BENZHYDRYLPIPERAZINES AS TACHYKININ ANTAGONISTS FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2002-07-18 WO claimed