Acetone

Acetone

SCHEMBL28023690

C1=CCCCC(C2=CC=CCCC2)=C1.CC(C)=O

nearest known ligand 0.33

Full drug profile on Sugi Atlas →

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 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
Acetic Acid SCHEMBL4212381 0.94 ALDH1A1 (0.32) ALDH1A1
SCHEMBL401731 0.86 ALDH1A1 (0.36) ALDH1A1
Propionic Acid SCHEMBL4194646 0.84 FFAR3 (0.37)
SCHEMBL27995143 0.84 ALDH1A1 (0.35) ALDH1A1
SCHEMBL27464350 0.84 ALDH1A1 (0.35) ALDH1A1
SCHEMBL27443379 0.84 ALDH1A1 (0.35) ALDH1A1
SCHEMBL27489614 0.84 ALDH1A1 (0.35) ALDH1A1
Carbon Monoxide SCHEMBL3890490 0.82 ALDH1A1 (0.36) ALDH1A1
Bromide SCHEMBL11059320 0.81 ALDH1A1 (0.33) ALDH1A1
SCHEMBL28625497 0.80 ALDH1A1 (0.30) ALDH1A1

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-204824675-U Bicycloheptadiene take off light system and control system thereof ZHONGTIAN KOSEN SHANGHAI ENTPR DEV CO LTD 2015-12-02 CN disclosed