SCHEMBL28118855

SCHEMBL28118855

C1CCOOC1.CCC(O)O

nearest known ligand 0.35

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.35

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
Tetrahydrofuran SCHEMBL28522855 0.82 ALDH1A1 (0.47) TSHR
Alcohol SCHEMBL2480371 0.78
Oxirane SCHEMBL27471704 0.78
Isopropyl Alcohol SCHEMBL4414291 0.78 ALDH1A1 (0.43)
SCHEMBL2311227 0.77 TSHR (0.47) TSHR
Cyclohexane SCHEMBL14778072 0.77 TSHR (0.47) TSHR
SCHEMBL28275293 0.76 LMNA (0.30)
Hexane SCHEMBL8134718 0.76 SPHK1 (0.37) TSHR
Dioxane SCHEMBL28118854 0.75 TTR (0.40) TSHR
Butane SCHEMBL27841986 0.74 ALDH1A1 (0.31)

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-106414598-A Firing paste composition and use thereof 综研化学株式会社 2017-02-15 CN disclosed