SCHEMBL28286649

SCHEMBL28286649

CC=CC(=O)CC[N+](CC)(CC)CC

nearest known ligand 0.31

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
TRPA1 O75762 1/20 0.31
DNM1 Q05193 2/20 0.30

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
Hydrochloric Acid SCHEMBL23451370 0.98 KDM4E (0.32) TRPA1
SCHEMBL28118332 0.77 ACHE (0.39)
SCHEMBL9408557 0.76 ALDH1A1 (0.48) DNM1
SCHEMBL531303 0.74
SCHEMBL531304 0.74
SCHEMBL6138662 0.74
SCHEMBL16353019 0.71 CYP2C19 (0.33)
Tetrylammonium SCHEMBL6552606 0.70 TSHR (0.40)
SCHEMBL4201474 0.70
SCHEMBL160883 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-105190971-B Optimal membrane electrochemical energy-storage system 洛克希德马丁能量有限公司 2019-03-29 CN claimed
CN-105190971-B Optimal membrane electrochemical energy-storage system 洛克希德马丁能量有限公司 2019-03-29 CN disclosed