SCHEMBL8406958

SCHEMBL8406958

CCC(CC)(c1cccc2ccoc12)C(N)O

nearest known ligand 0.38

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
KCNH2 Q12809 1/20 0.32
SLC6A2 P23975 1/20 0.32
SLC6A4 P31645 1/20 0.32
SLC6A3 Q01959 1/20 0.32

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
SCHEMBL19203370 0.74 MEN1 (0.35)
SCHEMBL19220449 0.70 EED (0.35) KCNH2
SCHEMBL2607624 0.70 CA2 (0.41) SLC6A2SLC6A4SLC6A3
SCHEMBL8406548 0.70
SCHEMBL19386439 0.68 EED (0.33) KCNH2
SCHEMBL7781715 0.68 KMT2A (0.35)
SCHEMBL31561735 0.67 LMNA (0.37)
SCHEMBL20858639 0.67 KCNH2 (0.37) KCNH2
SCHEMBL5988407 0.65 HTR2A (0.44) SLC6A2SLC6A4SLC6A3
SCHEMBL15582364 0.65 MEN1 (0.40) KCNH2

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-0923567-A1 BENZYLAMINE DERIVATIVES, THEIR PREPARATION AND THEIR APPLICATION IN THERAPEUTICS SYNTHELABO (FR) 1999-06-23 EP disclosed
WO-1998008834-A1 BENZYLAMINE DERIVATIVES, THEIR PREPARATION AND THEIR APPLICATION IN THERAPEUTICS SYNTHELABO (FR) 1998-03-05 WO disclosed