Cyclohexane

Cyclohexane

SCHEMBL7124692

C1CCCCC1.CCN(CC)CC.ClCCl

nearest known ligand 0.32

Full drug profile on Sugi Atlas →

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
HRH3 Q9Y5N1 1/20 0.32
LMNA P02545 1/20 0.32
SLC6A2 P23975 1/20 0.31
SLC6A4 P31645 1/20 0.31
SLC6A3 Q01959 1/20 0.31
MAPT P10636 2/20 0.30
CYP1A2 P05177 1/20 0.30
CYP2D6 P10635 1/20 0.30
TSHR P16473 1/20 0.30
NFKB1 P19838 1/20 0.30
CYP2C19 P33261 1/20 0.30
HSD17B10 Q99714 1/20 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
Cyclohexane SCHEMBL8471239 0.89 ADH1C (0.32) HRH3
Methylene Chloride SCHEMBL187626 0.89 ALDH1A1 (0.36) HRH3CYP1A2HSD17B10
Methylene Chloride SCHEMBL14696854 0.85 LMNA (0.35) LMNAMAPTTSHR
Fluoride SCHEMBL6463523 0.85 ADH1C (0.31) HRH3
Methylene Chloride SCHEMBL15348142 0.85 ALDH1A1 (0.33)
Methylene Chloride SCHEMBL9555746 0.85 ALDH1A1 (0.33)
Cyclohexane SCHEMBL10673286 0.83 HRH3 (0.31) HRH3
Methylene Chloride SCHEMBL153756 0.81 CYP2C9 (0.33) MAPTCYP1A2HSD17B10
Cyclopropane SCHEMBL28029468 0.81
Hydrochloric Acid SCHEMBL28029784 0.81

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20030105343-A1 Benzofuran compounds SHARP KABUSHIKI KAISHA (JP) 2003-06-05 US disclosed
US-4853408-A 4-phenylpropyl-indoles having antiarythmic activity ROUSSEL UCLAF (FR) 1989-08-01 US disclosed
US-4808609-A Amino-(hydroxy)alkoxy-4-phenylpropyl indoles having antiarrythmic activity ROUSSEL UCLAF (FR) 1989-02-28 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20030105343-A1 Benzofuran compounds BBOX1, DDO, OGFOD1 HRH3 3960/4885LMNA 859/4885SLC6A2 4450/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.