SCHEMBL16664749

SCHEMBL16664749

CCCC[C@H](CCC)C1CO1

nearest known ligand 0.44

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
THRB P10828 1/20 0.39
ALDH1A1 P00352 3/20 0.38
SMN1; SMN2 Q16637 1/20 0.33
DNM1 Q05193 2/20 0.32
TDP1 Q9NUW8 1/20 0.31
EPHX1 P07099 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
SCHEMBL51212 1.00 THRB (0.39) THRBALDH1A1SMN1; SMN2DNM1TDP1
SCHEMBL51913 0.95 THRB (0.41) THRBALDH1A1SMN1; SMN2DNM1TDP1
SCHEMBL50917 0.91 ALDH1A1 (0.32) ALDH1A1
SCHEMBL11031839 0.89 ALDH1A1 (0.45) THRBALDH1A1DNM1TDP1
SCHEMBL18886902 0.86 ALDH1A1 (0.46) ALDH1A1TDP1EPHX1
SCHEMBL51240 0.86 THRB (0.45) THRBALDH1A1SMN1; SMN2DNM1TDP1
SCHEMBL27945749 0.83 ALDH1A1 (0.40) THRBALDH1A1SMN1; SMN2
Methyl Alcohol SCHEMBL9341506 0.83 THRB (0.43) THRBALDH1A1SMN1; SMN2
SCHEMBL2833759 0.82 SMN1; SMN2 (0.44) THRBALDH1A1SMN1; SMN2TDP1
SCHEMBL2831088 0.82 SMN1; SMN2 (0.40) THRBALDH1A1SMN1; SMN2TDP1

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
US-9259710-B2 Separation material comprising saccharide ligands Gambro Lunia AB (SE) 2016-02-16 US disclosed
US-20150111194-A1 SEPARATION MATERIAL COMPRISING SACCHARIDE LIGANDS GAMBRO LUNDIA AB (SE) 2015-04-23 US disclosed