SCHEMBL5474453

SCHEMBL5474453

CC(C)CCCCC(N)N1CCNCC1

nearest known ligand 0.34

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.33
SIGMAR1 Q99720 1/20 0.31
SLC6A2 P23975 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
SCHEMBL7023231 0.85 GNAO1 (0.41) LMNASIGMAR1
SCHEMBL27826968 0.83 GNAO1 (0.43) LMNASIGMAR1
SCHEMBL8502189 0.83 GNAO1 (0.43) LMNASIGMAR1
SCHEMBL10705422 0.83 GNAO1 (0.43) LMNASIGMAR1
SCHEMBL10706538 0.83 GNAO1 (0.43) LMNASIGMAR1
SCHEMBL542927 0.82 SIGMAR1 (0.43) SIGMAR1SLC6A2SLC6A4
SCHEMBL7626764 0.81 DPP7 (0.34) LMNA
SCHEMBL991079 0.80 SLC6A4 (0.31) SLC6A2SLC6A4
SCHEMBL2116575 0.78 SIGMAR1 (0.36) SIGMAR1SLC6A2SLC6A4
SCHEMBL9420765 0.76 CYP2D6 (0.30) SLC6A2SLC6A4

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-20070022908-A1 Cationic-anionic blends for dynamic surface tension reduction AIR PRODUCTS AND CHEMICALS, INC. 2007-02-01 US disclosed