SCHEMBL6550226

SCHEMBL6550226

C=CCN1CCN(c2ccc(N)cc2)CC1

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 7/20 0.61
GFER P55789 4/20 0.61
GAA P10253 4/20 0.61
KDM4E B2RXH2 3/20 0.61
SMN1; SMN2 Q16637 3/20 0.61
RAD52 P43351 2/20 0.61
ALDH1A1 P00352 4/20 0.52
LMNA P02545 3/20 0.52
HTT P42858 2/20 0.52
KMT2A Q03164 2/20 0.52
MAPK1 P28482 1/20 0.52
TDP1 Q9NUW8 1/20 0.52
ADRA2C P18825 1/20 0.52
PTK2B Q14289 1/20 0.52
ESR2 Q92731 1/20 0.52
L3MBTL1 Q9Y468 2/20 0.48
MEN1 O00255 1/20 0.48
NPC1 O15118 1/20 0.48
USP2 O75604 1/20 0.48
TP53 P04637 1/20 0.48

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
SCHEMBL17194427 0.82 MAPT (0.51) MAPTGFERGAAKDM4ESMN1; SMN2
SCHEMBL1018073 0.82 MAPT (0.61) MAPTGFERGAAKDM4ESMN1; SMN2
SCHEMBL175992 0.81 CHRNA7 (0.58) MAPTKDM4ESMN1; SMN2ALDH1A1HTT
SCHEMBL4687789 0.80 TMEM97 (0.42) MAPTGFERGAAKDM4ESMN1; SMN2
SCHEMBL7423220 0.79 OPRD1 (0.60) MAPTGAASIGMAR1HTR7CYP1A2
SCHEMBL6550223 0.79 KMT2A (0.51) ALDH1A1HTTKMT2AMEN1NPC1
SCHEMBL3263264 0.79 MAPT (0.43) MAPTGFERGAAKDM4ESMN1; SMN2
SCHEMBL6698558 0.78 MAPT (0.60) MAPTGFERGAAKDM4ESMN1; SMN2
SCHEMBL23347931 0.78 MAPT (0.77) MAPTGFERGAAKDM4ESMN1; SMN2
SCHEMBL7043679 0.78 MAPT (0.77) MAPTGFERGAAKDM4ESMN1; 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 7 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1383753-A1 PIPERAZINE-BENZAMIDE DERIVATIVES USEFUL AS APOB-100 AND/OR MTP INHIBITOR GLAXO GROUP LIMITED (GB) 2004-01-28 EP claimed
WO-2003047575-A1 THERAPEUTIC BENZAMIDE DERIVATIVES GLAXO GROUP LIMITED (GB) 2003-06-12 WO claimed
WO-2002083658-A1 PIPERAZINE-BENZAMIDE DERIVATIVES USEFUL AS APOB-100 AND/OR MTP INHIBITOR GLAXO GROUP LIMITED (GB) 2002-10-24 WO claimed
EP-1383753-A1 PIPERAZINE-BENZAMIDE DERIVATIVES USEFUL AS APOB-100 AND/OR MTP INHIBITOR GLAXO GROUP LIMITED (GB) 2004-01-28 EP disclosed
WO-2003047575-A1 THERAPEUTIC BENZAMIDE DERIVATIVES GLAXO GROUP LIMITED (GB) 2003-06-12 WO disclosed
WO-2003048121-A1 THERAPEUTIC BENZAMIDE DERIVATIVES GLAXO GROUP LIMITED (GB) 2003-06-12 WO disclosed
WO-2002083658-A1 PIPERAZINE-BENZAMIDE DERIVATIVES USEFUL AS APOB-100 AND/OR MTP INHIBITOR GLAXO GROUP LIMITED (GB) 2002-10-24 WO disclosed