SCHEMBL2553676

SCHEMBL2553676

[CH]1CCCN1C1CCNC1

nearest known ligand 0.38

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
HTR6 P50406 1/20 0.38
HTR2C P28335 1/20 0.30
HTR2B P41595 1/20 0.30

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
SCHEMBL8491316 0.94 HTR6 (0.41) HTR6
SCHEMBL2265420 0.88 HTR2C (0.33) HTR2CHTR2B
SCHEMBL5408429 0.85 HTR6 (0.44) HTR6HTR2CHTR2B
SCHEMBL18073900 0.83
SCHEMBL352142 0.82 HTR2C (0.33) HTR6HTR2CHTR2B
SCHEMBL5969664 0.80 HTR2C (0.32) HTR6HTR2CHTR2B
SCHEMBL23478571 0.79
SCHEMBL738459 0.75
SCHEMBL735469 0.73 CTDSP1 (0.31)
SCHEMBL735857 0.73

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2558067-A2 COMPOUNDS, COMPOSITIONS, AND METHODS FOR REDUCING OR ELIMINATING BITTER TASTE Chromocell Corporation (US) 2013-02-20 EP disclosed
WO-2011130707-A2 COMPOUNDS, COMPOSITIONS, AND METHODS FOR REDUCING OR ELIMINATING BITTER TASTE CHROMOCELL CORPORATION (US) 2011-10-20 WO disclosed
CN-1152305-A Substituted 3-phenylpyrazoles as herbicides BASF AG (DE) 1997-06-18 CN disclosed