Cyclohexane

Cyclohexane

SCHEMBL3463183

C1CCCCC1.CC(C)C(=O)C(C)C

nearest known ligand 0.44

Full drug profile on Sugi Atlas →

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
TP53 P04637 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
SCHEMBL25173 0.88
Water SCHEMBL4085909 0.84 TP53 (0.38) TP53
SCHEMBL28586071 0.84
SCHEMBL27682044 0.84
Hydrogen Peroxide SCHEMBL374975 0.84 TP53 (0.47) TP53
Methyl Alcohol SCHEMBL8763775 0.84 TP53 (0.38) TP53
Water SCHEMBL18229925 0.84
Fluoride SCHEMBL4652779 0.84
Cyclohexanone SCHEMBL5694918 0.81 TRIM24 (0.55)
Cyclohexanol SCHEMBL11413016 0.81 TSHR (0.50)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8278333-B2 Crystals of benzoxadiazole derivative ASTELLAS PHARMA INC. (JP) 2012-10-02 US disclosed
US-20100178432-A1 Method of Forming Pattern Film, and Pattern Film Forming Apparatus KONICA MINOLTA HOLDINGS, INC. (JP) 2010-07-15 US disclosed
US-20090203741-A1 CRYSTALS OF BENZOXADIAZOLE DERIVATIVE ASTELLAS PHARMA INC. (JP) 2009-08-13 US disclosed
EP-2042498-A1 CRYSTAL OF BENZOXADIAZOLE DERIVATIVE Astellas Pharma Inc. (JP) 2009-04-01 EP disclosed
US-20050243428-A1 Optical functional sheet TAKAHASHI HIROMITSU 2005-11-03 US disclosed
US-6937399-B2 Optical functional sheet TORAY INDUSTRIES, INC. (JP) 2005-08-30 US disclosed
US-20040047042-A1 Optical functional sheet TORAY INDUSTRIES, INC. (JP) 2004-03-11 US disclosed
EP-1369711-A1 OPTICAL FUNCTIONAL SHEET TORAY INDUSTRIES, INC. (JP) 2003-12-10 EP 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-20090203741-A1 CRYSTALS OF BENZOXADIAZOLE DERIVATIVE LBR, XDH, CYP4B1 TP53 4755/4885

“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.