Cyclohexane

Cyclohexane

SCHEMBL3060053

C1CCCCC1.C=CCNCC=C.C=CCNCC=C

nearest known ligand 0.36

Full drug profile on Sugi Atlas →

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.35
TSHR P16473 2/20 0.33
KMT2A Q03164 1/20 0.33
GAA P10253 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.31
MAPT P10636 1/20 0.31

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
Cyclopropane SCHEMBL28025983 1.00 ALDH1A1 (0.35) ALDH1A1TSHRKMT2AGAASMN1; SMN2
SCHEMBL10629680 1.00 ALDH1A1 (0.35) ALDH1A1TSHRKMT2AGAASMN1; SMN2
Cyclohexane SCHEMBL11220300 1.00 ALDH1A1 (0.35) ALDH1A1TSHRKMT2AGAASMN1; SMN2
SCHEMBL22105 0.89
SCHEMBL27922143 0.89 TSHR (0.38) ALDH1A1TSHRKMT2ASMN1; SMN2MAPT
Methane SCHEMBL23927285 0.85
Hydrochloric Acid SCHEMBL220991 0.85
SCHEMBL9402771 0.85 TSHR (0.36) ALDH1A1TSHRKMT2ASMN1; SMN2MAPT
SCHEMBL3312437 0.85
Water SCHEMBL1155773 0.85

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100266526-A1 Combination therapy for treating hypercholesterolemia GENZYME CORPORATION (US) 2010-10-21 US disclosed
US-7638524-B2 For reducing serum cholesterol in a mammal GENZYME CORPORATION (US) 2009-12-29 US disclosed
EP-1028717-B1 UNSUBSTITUTED POLYDIALLYLAMINE FOR TREATING HYPERCHOLESTEROLEMIA GELTEX PHARMA INC (US) 2003-03-26 EP disclosed
US-20020155091-A1 Combination therapy for treating hypercholesterolemia GELTEX PHARMACEUTICALS, INC. 2002-10-24 US disclosed
US-6365186-B1 ADMINISTERING TO PATIENT UNSUBSTITUTED POLYDIALLYLAMINE POLYMER AND CHOLESTEROL-LOWERING AGENT IN THERAPEUTICALLY EFFECTIVE AMOUNT GELTEX PHARMACEUTICALS, INC. 2002-04-02 US disclosed
US-6264938-B1 ADMINISTERING POLYDIALLYLAMINE AND HYDROXY-3-METHYLGLUTARYL/3-/, COENZYME A REDUCTASE GELTEX PHARMACEUTICALS, INC. 2001-07-24 US disclosed
US-6248318-B1 ADMINISTERING DOSAGE INTO GASTROINTESTINAL TRACT GELTEX PHARMACEUTICALS, INC. 2001-06-19 US disclosed
WO-2000069446-A1 COMBINATION THERAPY FOR TREATING HYPERCHOLESTEROLEMIA GELTEX PHARMACEUTICALS, INC. (US) 2000-11-23 WO disclosed
WO-2000069445-A1 COMBINATION THERAPY FOR TREATING HYPERCHOLESTEROLEMIA GELTEX PHARMACEUTICALS, INC. (US) 2000-11-23 WO disclosed
EP-1028717-A2 UNSUBSTITUTED POLYDIALLYLAMINE FOR TREATING HYPERCHOLESTEROLEMIA GELTEX PHARMACEUTICALS, INC. (US) 2000-08-23 EP disclosed
US-6083497-A REMOVING BILE SALTS FROM A PATIENT BY ADMINISTERING A THERAPEUTICALLY EFFECTIVE AMOUNT OF A NON-ABSORBABLE POLYDIALLYLAMINE POLYMER GELTEX PHARMACEUTICALS, INC. (US) 2000-07-04 US disclosed
WO-1999022721-A2 UNSUBSTITUTED POLYDIALLYLAMINE FOR TREATING HYPERCHOLESTEROLEMIA GELTEX PHARMACEUTICALS, INC. (US) 1999-05-14 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-20020155091-A1 Combination therapy for treating hypercholesterolemia PCSK9, SLC10A1, NR1H4 ALDH1A1 2748/4885TSHR 4561/4885KMT2A 1418/4885
US-20100266526-A1 Combination therapy for treating hypercholesterolemia PCSK9, SLC10A1, NR1H4 ALDH1A1 2748/4885TSHR 4561/4885KMT2A 1418/4885

“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.