SCHEMBL28136372

SCHEMBL28136372

C=C(C)C(=O)OC(=O)CC(C)(C)C

nearest known ligand 0.41

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.41
TSHR P16473 3/20 0.38
THRB P10828 1/20 0.35
HSD17B10 Q99714 1/20 0.32
TDP1 Q9NUW8 1/20 0.32
MIF P14174 1/20 0.31
LMNA P02545 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
SCHEMBL28305949 0.84 MIF (0.32) MIFLMNA
SCHEMBL28304892 0.82 MIF (0.33) MIFLMNA
SCHEMBL4205584 0.81 ALDH1A1 (0.39) ALDH1A1TSHRTHRBHSD17B10TDP1
SCHEMBL28304859 0.80 MIF (0.32) MIFLMNA
SCHEMBL28305953 0.80 MIF (0.32) MIFLMNA
SCHEMBL28874728 0.80 MIF (0.32) MIFLMNA
SCHEMBL28304870 0.80 MIF (0.32) MIFLMNA
SCHEMBL28305944 0.80 MIF (0.32) MIFLMNA
SCHEMBL28362979 0.80 MIF (0.32) MIFLMNA
SCHEMBL28304864 0.80 ALDH1A1 (0.32) ALDH1A1MIFLMNA

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
CN-104797412-B Including the pneumatic tire of rubber liner that bonded by fiber module and its manufacture method 米其林集团总公司 2017-03-08 CN disclosed