Cyclohexane

Cyclohexane

SCHEMBL2292997

C1CCCCC1.C1CCCCC1.C1CCCCC1.C1CCCCC1.C1CCCCC1.C1CCCCC1.C1CCCCC1.C1CCCCC1.C1CCCCC1.CCOCC

nearest known ligand 0.39

Full drug profile on Sugi Atlas →

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.39
TSHR P16473 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
Cyclooctane SCHEMBL28098731 1.00 ALDH1A1 (0.39) ALDH1A1TSHR
Cyclohexane SCHEMBL7376420 1.00 ALDH1A1 (0.39) ALDH1A1TSHR
Cycloheptane SCHEMBL27831919 1.00 ALDH1A1 (0.39) ALDH1A1TSHR
Ether SCHEMBL232500 1.00
Cyclopentane SCHEMBL8923462 1.00 ALDH1A1 (0.39) ALDH1A1TSHR
Cyclohexane SCHEMBL2297628 1.00 ALDH1A1 (0.39) ALDH1A1TSHR
Cyclohexane SCHEMBL8441380 1.00 ALDH1A1 (0.39) ALDH1A1TSHR
Cyclohexane SCHEMBL251247 1.00 ALDH1A1 (0.39) ALDH1A1TSHR
Cyclohexane SCHEMBL8441382 1.00 ALDH1A1 (0.39) ALDH1A1TSHR
Cyclohexane SCHEMBL9286703 1.00 ALDH1A1 (0.39) ALDH1A1TSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2361920-A2 Preparation and use of carbohydrate-based ring structures with antimicrobial and cytostatic activity Kemin Pharma Europe (US) 2011-08-31 EP disclosed
EP-2168972-A2 Preparation and use of carbohydrate-based ring structures with antimicrobial and cytostatic activity Kemin Pharma Europe (US) 2010-03-31 EP disclosed
US-7534871-B2 Carbohydrate scaffold, carrying two side chains, which form a macrocyclic ring that may be unsaturated and contains ether, amide, ester and/or carbamate groups; for therapy of bacterial, fungal, viral or protozoal infections or tumors KEMIN PHARMA B.V.B.A. (US) 2009-05-19 US disclosed
EP-1446391-A4 PREPARATION AND USE OF CARBOHYDRATE-BASED RING STRUCTURES WITH ANTIMICROBIAL AND CYTOSTATIC ACTIVITY KEMIN PHARMA EUROP (US) 2008-02-20 EP disclosed
US-7138531-B2 Preparation and use of carbohydrate-based bicyclic ring structures with antimicrobial and cytostatic activity KEMIN PHARMA B.V.B.A. (US) 2006-11-21 US disclosed
US-7101908-B2 Bicyclic carbohydrate compounds useful in the treatment of infections caused by herpesviridae KEMIN PHARMA EUROPE B.V.B.A. (US) 2006-09-05 US disclosed
EP-1590357-A2 BICYCLIC CARBOHYDRATE COMPOUNDS USEFUL IN THE TREATMENT OF INFECTIONS CAUSED BY FLAVIVIRIDAE SP., SUCH AS HEPATITIS C AND BOVINE VIRAL DIARRHEA VIRUSES Kemin Pharma Europe BVBA (US) 2005-11-02 EP disclosed
WO-2005062748-A2 BICYCLIC CARBOHYDRATE COMPOUNDS USEFUL IN THE TREATMENT OF INFECTIONS CAUSED BY HERPESVIRIDAE KEMIN PHARMA EUROPE B.V.B.A. (BE) 2005-07-14 WO disclosed
US-20040224904-A1 Preparation and use of carbohydrate-based bicyclic ring structures with antimicrobial and cytostatic activity SAS BENEDIKT (BE) 2004-11-11 US disclosed
EP-1446391-A2 PREPARATION AND USE OF CARBOHYDRATE-BASED RING STRUCTURES WITH ANTIMICROBIAL AND CYTOSTATIC ACTIVITY Kemin Pharma Europe (US) 2004-08-18 EP disclosed
WO-2004062575-A2 BICYCLIC CARBOHYDRATE COMPOUNDS USEFUL IN THE TREATMENT OF INFECTIONS CAUSED BY FLAVIVIRIDAE SP., SUCH AS HEPATITIS C AND BOVINE VIRAL DIARRHEA VIRUSES KEMIN PHARMA EUROPE BVBA (US) 2004-07-29 WO disclosed
WO-2004062590-A2 BICYCLIC CARBOHYDRATES AS ANTIPROTOZOAL BIOACTIVE FOR THE TREATMENT OF INFECTIONS CAUSED BY PARASITES KEMIN PHARMA EUROPE B.V.B.A. (US) 2004-07-29 WO disclosed
US-20030158243-A1 Preparation and use of carbohydrate-based bicyclic ring structures with antimicrobial and cytostatic activity KEMIN PHARMA EUROPE (BE) 2003-08-21 US disclosed
WO-2003032905-A2 PREPARATION AND USE OF CARBOHYDRATE-BASED RING STRUCTURES WITH ANTIMICROBIAL AND CYTOSTATIC ACTIVITY KEMIN PHARMA EUROPE (US) 2003-04-24 WO 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 (2 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-20030158243-A1 Preparation and use of carbohydrate-based bicyclic ring structures with antimicrobial and cytostatic activity MANBA, MAN2B1, MAN1B1 ALDH1A1 2417/4885TSHR 4382/4885
US-20040224904-A1 Preparation and use of carbohydrate-based bicyclic ring structures with antimicrobial and cytostatic activity MANBA, MAN2B1, MAN1B1 ALDH1A1 2417/4885TSHR 4382/4885

“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.