SCHEMBL28909560

SCHEMBL28909560

CC(C)C(=O)C#CCCCC#N

nearest known ligand 0.36

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.36

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
SCHEMBL995365 0.81 HMGCR (0.41) TSHR
SCHEMBL31390455 0.79
SCHEMBL28909536 0.79 PTPN7 (0.31)
SCHEMBL31390449 0.78 PTPN7 (0.50)
SCHEMBL28909520 0.76
SCHEMBL2121938 0.76 GRIK1 (0.35) TSHR
Oxalic Acid SCHEMBL11668447 0.71 TSHR (0.43) TSHR
SCHEMBL28909478 0.71
SCHEMBL6957514 0.70
SCHEMBL25762162 0.70

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-115322211-B Preparation method of alkenyl substituted-alpha-hydroxy borate compound 香港科技大学深圳研究院 2025-02-25 CN disclosed
CN-115322211-A Preparation method of alkenyl-substituted-alpha-hydroxy borate compound 香港科技大学深圳研究院 2022-11-11 CN disclosed