SCHEMBL5709662

SCHEMBL5709662

CCC(O)C(O)C1CCCCC1N

nearest known ligand 0.35

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
THRB P10828 1/20 0.35
MEN1 O00255 1/20 0.35
KMT2A Q03164 1/20 0.35
SHBG P04278 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
SCHEMBL9402900 0.81 THRB (0.39) THRBMEN1KMT2ASHBG
SCHEMBL25959618 0.77 THRB (0.33) THRBMEN1KMT2ASHBG
SCHEMBL13952341 0.74 THRB (0.41) THRBMEN1KMT2ASHBG
SCHEMBL13952290 0.74 THRB (0.41) THRBMEN1KMT2ASHBG
SCHEMBL13952181 0.74 THRB (0.41) THRBMEN1KMT2ASHBG
SCHEMBL13462490 0.74 THRB (0.41) THRBMEN1KMT2ASHBG
SCHEMBL24742714 0.72 THRB (0.39) THRBMEN1KMT2ASHBG
SCHEMBL9154707 0.72 THRB (0.39) THRBMEN1KMT2ASHBG
SCHEMBL2451853 0.72 THRB (0.39) THRBMEN1KMT2ASHBG
SCHEMBL9439852 0.72 THRB (0.39) THRBMEN1KMT2ASHBG

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
EP-1712227-A1 Amino diols useful in the treatment of Alzheimer's disease Elan Pharmaceuticals, Inc. (US) 2006-10-18 EP claimed