SCHEMBL27448641

SCHEMBL27448641

CC(C)C(=O)OC(=O)C(C)C.[AlH3].[Y]

nearest known ligand 0.39

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.38
ELANE P08246 2/20 0.34
SMN1; SMN2 Q16637 1/20 0.32
ALDH1A1 P00352 2/20 0.32
SOAT1 P35610 1/20 0.30
MIF P14174 1/20 0.30
TP53 P04637 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
SCHEMBL28746772 0.97 TSHR (0.40) TSHRELANESMN1; SMN2ALDH1A1SOAT1
SCHEMBL16250 0.93 TSHR (0.42) TSHRELANESMN1; SMN2ALDH1A1SOAT1
Methyl Alcohol SCHEMBL28095566 0.90 TSHR (0.40) TSHRELANESMN1; SMN2ALDH1A1SOAT1
SCHEMBL28493562 0.84 TP53 (0.42) TSHRELANESMN1; SMN2TP53
SCHEMBL5706390 0.83 ALDH1A1 (0.42) TSHRALDH1A1SOAT1
SCHEMBL5706391 0.83 ALDH1A1 (0.42) TSHRALDH1A1SOAT1
SCHEMBL10934916 0.81 TSHR (0.59) TSHRELANESMN1; SMN2ALDH1A1
SCHEMBL22775062 0.81 TSHR (0.59) TSHRELANESMN1; SMN2ALDH1A1
Sulfuric Acid SCHEMBL27904281 0.81 CA14 (0.37) TSHRELANEALDH1A1TP53
SCHEMBL249383 0.80 TSHR (0.38) TSHRELANESMN1; SMN2ALDH1A1SOAT1

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
CN-1137298-C Process for preparing polycrystalline yttrium aluminate fibre 中国科学院山西煤炭化学研究所 2004-02-04 CN disclosed
CN-1377997-A Process for preparing polycrystalline yttrium aluminate fibre SHANXI COAL CHEM INST (CN) 2002-11-06 CN disclosed