SCHEMBL648734

SCHEMBL648734

[CH2]C(CCOCCC)OCC

nearest known ligand 0.34

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
HSD17B10 Q99714 1/20 0.34
THRB P10828 1/20 0.33
TDP1 Q9NUW8 1/20 0.33
LMNA P02545 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
SCHEMBL4453373 0.91 HSD17B10 (0.34) HSD17B10TDP1
SCHEMBL1019320 0.85 ALDH1A1 (0.38) THRBLMNA
SCHEMBL8419757 0.85 TSHR (0.37) HSD17B10TDP1
SCHEMBL648735 0.84 ALDH1A1 (0.33) THRBLMNA
SCHEMBL9599216 0.82 ALDH1A1 (0.48) THRB
SCHEMBL10967124 0.81 TDP1 (0.34) TDP1
SCHEMBL7803128 0.79
SCHEMBL15013921 0.77 HSD17B10 (0.37) HSD17B10TDP1
SCHEMBL28033462 0.77 TSHR (0.43) THRB
SCHEMBL7631830 0.76 ALDH1A1 (0.35) THRBLMNA

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
US-8119667-B2 Carbonates of fenicol antibiotics SCHERING-PLOUGH ANIMAL HEALTH CORPORATION (US) 2012-02-21 US claimed