Cyclohexane

Cyclohexane

SCHEMBL28869979

C1CCCCC1.CC(C)=O.ClC(Cl)Cl.O=CO

nearest known ligand 0.35

Full drug profile on Sugi Atlas →

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.35

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
Acetone SCHEMBL7873135 0.91 LMNA (0.43) LMNA
Acetone SCHEMBL27477332 0.88 LMNA (0.40) LMNA
Acetone SCHEMBL28267884 0.88 LMNA (0.40) LMNA
Cyclohexane SCHEMBL29037986 0.88 LMNA (0.31) LMNA
Cyclohexane SCHEMBL9811669 0.87 LMNA (0.46) LMNA
Cyclohexane SCHEMBL28817916 0.81 ALDH1A1 (0.40) LMNA
Acetic Acid SCHEMBL28586564 0.81 FFAR3 (0.47) LMNA
Acetic Acid SCHEMBL27529054 0.79 FFAR3 (0.44) LMNA
Cyclohexane SCHEMBL7317759 0.78 FFAR3 (0.50) LMNA
Chloroform SCHEMBL609513 0.77

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-115097029-A Thin-layer fingerprint information spot identification method for venenum bufonis medicinal materials 浙江金大康动物保健品有限公司 2022-09-23 CN claimed
CN-115097029-A Thin-layer fingerprint information spot identification method for venenum bufonis medicinal materials 浙江金大康动物保健品有限公司 2022-09-23 CN disclosed