SCHEMBL8971968

SCHEMBL8971968

OCCNCC(CCOC1CCCCO1)c1ccc(Cl)c(Cl)c1

nearest known ligand 0.42

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
SLC6A3 Q01959 8/20 0.42
KDM4C Q9H3R0 1/20 0.36
NPC1 O15118 1/20 0.36
RAB9A P51151 1/20 0.36
MCHR1 Q99705 2/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
MEN1 O00255 1/20 0.35
KMT2A Q03164 1/20 0.35
L3MBTL1 Q9Y468 1/20 0.34
KCNA5 P22460 1/20 0.34
SCN5A Q14524 1/20 0.34
SLC6A2 P23975 1/20 0.34
SLC6A4 P31645 1/20 0.34

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
SCHEMBL8592474 0.89 SLC6A3 (0.44) SLC6A3KDM4CNPC1RAB9ASLC6A2
SCHEMBL8782641 0.86 SLC6A3 (0.46) SLC6A3KDM4CNPC1RAB9AL3MBTL1
SCHEMBL6579345 0.86 SLC6A3 (0.45) SLC6A3KDM4CNPC1RAB9AMEN1
SCHEMBL8971716 0.86 L3MBTL1 (0.38) KDM4CNPC1RAB9AMCHR1MEN1
Hydrochloric Acid SCHEMBL8369516 0.85 SLC6A3 (0.45) SLC6A3KDM4CNPC1RAB9AL3MBTL1
SCHEMBL6947372 0.84 KDM4C (0.39) SLC6A3KDM4CNPC1RAB9AMCHR1
SCHEMBL5858706 0.82 SLC6A3 (0.42) SLC6A3KDM4CNPC1RAB9AMEN1
SCHEMBL7305694 0.81 SLC6A3 (0.44) SLC6A3KDM4CNPC1RAB9AMEN1
SCHEMBL5866431 0.80 MCHR1 (0.44) SLC6A3MCHR1SMN1; SMN2MEN1KMT2A
SCHEMBL8782510 0.80 SLC6A3 (0.48) SLC6A3MCHR1SMN1; SMN2SLC6A2SLC6A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0700382-A1 NOVEL N-ARYLALIPHATIC-N-ALKYL-FUNCTIONALISED AMIDES, METHOD FOR THEIR PREPATION AND PHARMACEUTICAL COMPOSITIONS CONTAINING SAME SANOFI (FR) 1996-03-13 EP disclosed
WO-1995026335-A1 NOVEL N-ARYLALIPHATIC-N-ALKYL-FUNCTIONALISED AMIDES, METHOD FOR THEIR PREPARATION AND PHARMACEUTICAL COMPOSITIONS CONTAINING SAME SANOFI (FR) 1995-10-05 WO disclosed