SCHEMBL28118534

SCHEMBL28118534

O=C(OC(=O)OC(C(=O)O)C(O)C(=O)O)OC(=O)OC(C(=O)O)C(O)C(=O)O.[CaH2].[CaH2].[SrH2].[SrH2]

nearest known ligand 0.38

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.38
SRC P12931 1/20 0.34

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
SCHEMBL7516079 0.84 TSHR (0.47) TSHRSRC
SCHEMBL20565537 0.75 TSHR (0.43) TSHRSRC
SCHEMBL1263842 0.74 TSHR (0.47) TSHRSRC
SCHEMBL7516069 0.74 TSHR (0.47) TSHRSRC
SCHEMBL20565536 0.73 TSHR (0.48) TSHRSRC
SCHEMBL4950263 0.72 TSHR (0.45) TSHRSRC
SCHEMBL1431069 0.72 TSHR (0.45) TSHRSRC
SCHEMBL28888435 0.71 ALDH1A1 (0.46) TSHRSRC
SCHEMBL184960 0.70 TSHR (0.50) TSHRSRC
SCHEMBL305066 0.70 TSHR (0.43) TSHRSRC

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-103921964-B A kind of novel micropowder packer 上海陆达包装机械制造有限公司 2017-01-04 CN disclosed