SCHEMBL28385306

SCHEMBL28385306

CC(C#N)OOP(=O)(OOC(C)C#N)OOC(C)C#N

nearest known ligand 0.32

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
▸ TSHR P16473 1/20 0.32

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
SCHEMBL3388389 0.81 — —
SCHEMBL2180330 0.81 — —
SCHEMBL22651 0.74 TSHR (0.35) TSHR
SCHEMBL3369026 0.70 TSHR (0.32) TSHR
SCHEMBL4065726 0.69 CTSA (0.36) —
Ethylene SCHEMBL11311019 0.69 TSHR (0.41) TSHR
SCHEMBL28577036 0.67 — —
SCHEMBL27802264 0.65 CTSA (0.33) —
SCHEMBL5024254 0.65 — —
SCHEMBL4028324 0.65 TSHR (0.32) TSHR

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-111106384-B Electrolyte matched with high-nickel anode lithium ion battery 中国科学院福建物质结构研究所 2021-02-12 — — CN claimed
CN-111106384-A Electrolyte matched with high-nickel anode lithium ion battery 中国科学院福建物质结构研究所 2020-05-05 — — CN claimed
CN-111106384-B Electrolyte matched with high-nickel anode lithium ion battery 中国科学院福建物质结构研究所 2021-02-12 — — CN disclosed
CN-111106384-A Electrolyte matched with high-nickel anode lithium ion battery 中国科学院福建物质结构研究所 2020-05-05 — — CN disclosed
Send feedback