SCHEMBL28587131

SCHEMBL28587131

[LiH].[Li]C1=C(C)C(C)=C(C)C1(C)C

nearest known ligand 0.33

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
CTSD P07339 1/20 0.33

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
SCHEMBL2419351 0.97 CTSD (0.35) CTSD
SCHEMBL2230540 0.73 CTSD (0.43) CTSD
SCHEMBL8757058 0.67 CTSD (0.35) CTSD
SCHEMBL28961651 0.65 CTSD (0.38) CTSD
Hydrochloric Acid SCHEMBL8069109 0.65 CTSD (0.33) CTSD
SCHEMBL9143816 0.65 CTSD (0.33) CTSD
SCHEMBL4576329 0.63 CTSD (0.32) CTSD
Fluoride Ion SCHEMBL5613214 0.63 CTSD (0.32) CTSD
Hydrochloric Acid SCHEMBL137721 0.63 CTSD (0.32) CTSD
Bromide SCHEMBL7870145 0.63 CTSD (0.32) CTSD

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-109097117-B Energy-saving and environment-friendly gasoline combustion improver and preparation method thereof 北京燧火科技有限公司 2021-07-06 CN disclosed