SCHEMBL6926306

SCHEMBL6926306

NCCCNC1CCc2ccccc21

nearest known ligand 0.56

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
MAOA P21397 4/20 0.56
MAOB P27338 4/20 0.56
BCHE P06276 1/20 0.56
ADRA2B P18089 1/20 0.56
ADRA2C P18825 1/20 0.56
ACHE P22303 1/20 0.56
ADRA1A P35348 1/20 0.56
HTR6 P50406 1/20 0.56
PDPK1 O15530 1/20 0.53
CA1 P00915 1/20 0.50
CA2 P00918 1/20 0.50
KDM1A O60341 3/20 0.47
EPHX2 P34913 2/20 0.45
HTR2A P28223 2/20 0.43
RET P07949 1/20 0.43
SLC18A3 Q16572 1/20 0.43
HRH1 P35367 1/20 0.42

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
SCHEMBL172566 0.84 MAOA (0.60) MAOAMAOBBCHEADRA2BADRA2C
SCHEMBL18995764 0.83 MAOA (0.59) MAOAMAOBBCHEADRA2BADRA2C
SCHEMBL6923878 0.83 MAOA (0.59) MAOAMAOBBCHEADRA2BADRA2C
SCHEMBL15131125 0.81 EPHX2 (0.66) MAOAMAOBBCHEADRA2BADRA2C
SCHEMBL8084415 0.81 EPHX2 (0.66) MAOAMAOBBCHEADRA2BADRA2C
SCHEMBL2463259 0.80 MAOA (0.56) MAOAMAOBBCHEADRA2BADRA2C
SCHEMBL172262 0.80 MAOA (0.64) MAOAMAOBBCHEADRA2BADRA2C
SCHEMBL13911216 0.80 MAOA (0.64) MAOAMAOBBCHEADRA2BADRA2C
SCHEMBL6928172 0.80 MAOA (0.49) MAOAMAOBBCHEADRA2BADRA2C
Hydrochloric Acid SCHEMBL6930816 0.79 MAOA (0.48) MAOAMAOBBCHEADRA2BADRA2C

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0865276-A4 POLYAMINE DERIVATIVES OF 1-AMINOINDAN GILAD GAD (IL) 2003-07-30 EP claimed
EP-0865276-A1 POLYAMINE DERIVATIVES OF 1-AMINOINDAN Gilad, Gad (IL) 1998-09-23 EP claimed
US-5646188-A FOR TREATING NEUROTRAUMA TEVA PHARMACEUTICAL INDUSTRIES, LTD. (IL) 1997-07-08 US claimed
WO-1997002027-A1 POLYAMINE DERIVATIVES OF 1-AMINOINDAN TEVA PHARMACEUTICAL INDUSTRIES, LTD. (IL) 1997-01-23 WO claimed
EP-0865276-A4 POLYAMINE DERIVATIVES OF 1-AMINOINDAN GILAD GAD (IL) 2003-07-30 EP disclosed
EP-0865276-A1 POLYAMINE DERIVATIVES OF 1-AMINOINDAN Gilad, Gad (IL) 1998-09-23 EP disclosed
US-5646188-A FOR TREATING NEUROTRAUMA TEVA PHARMACEUTICAL INDUSTRIES, LTD. (IL) 1997-07-08 US disclosed
WO-1997002027-A1 POLYAMINE DERIVATIVES OF 1-AMINOINDAN TEVA PHARMACEUTICAL INDUSTRIES, LTD. (IL) 1997-01-23 WO disclosed