SCHEMBL2344665

SCHEMBL2344665

CC1CC(=O)C(C)C(C)C1

nearest known ligand 0.35

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
CRBN Q96SW2 1/20 0.35
SMN1; SMN2 Q16637 2/20 0.33
NOS3 P29474 1/20 0.30
NOS1 P29475 1/20 0.30
NOS2 P35228 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
SCHEMBL2692353 0.77
SCHEMBL10990011 0.75 CRBN (0.32) CRBN
SCHEMBL18031731 0.73 ALDH1A1 (0.38)
SCHEMBL12265748 0.73 ALDH1A1 (0.38)
SCHEMBL1608535 0.72
SCHEMBL19809831 0.72 MEN1 (0.41) CRBN
SCHEMBL19335911 0.72
SCHEMBL14369920 0.72 CRBN (0.30) CRBN
SCHEMBL20106241 0.72 TSHR (0.31)
SCHEMBL19785444 0.72

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-117303995-A Method for preparing high-tension quaternary cycloalkane fuel by cyclic ketone or cyclic alcohol one-pot method and application of fuel 西北工业大学重庆科创中心 2023-12-29 CN claimed
CN-117303995-A Method for preparing high-tension quaternary cycloalkane fuel by cyclic ketone or cyclic alcohol one-pot method and application of fuel 西北工业大学重庆科创中心 2023-12-29 CN disclosed
EP-1544190-B1 METHOD FOR PRODUCING CARBOXYLIC ACIDS NAT INST OF ADVANCED IND SCIEN (JP) 2011-08-31 EP disclosed
US-7186858-B2 Method for producing carboxylic acid NATIONAL INSTITUTE OF ADVANCED INDUSTRIAL SCIENCE AND TECHNOLOGY (JP) 2007-03-06 US disclosed
US-20060167305-A1 Novel (meth)acrylates and methods of producing thereof HONSHU CHEMICAL INDUSTRY CO., LTD. (JP) 2006-07-27 US disclosed
US-20050215817-A1 Method for producing carboxylic acid NATIONAL INSTITUTE OF ADVANCED INDUSTRIAL SCIENCE AND TECHNOLOGY (JP) 2005-09-29 US disclosed
EP-1544190-A1 METHOD FOR PRODUCING CARBOXYLIC ACID National Institute of Advanced Industrial Science and Technology (JP) 2005-06-22 EP disclosed
US-5759528-A AMINE OXIDE SURFACTANT AND CYCLOHEXANE, CYCLOHEXENE OR CYCLOHEXANONE DERIVATIVE INSTITUTE FOR ADVANCED SKIN RESEARCH, INC. (JP) 1998-06-02 US disclosed
EP-0745389-A1 COMPOSITION FOR TOPICAL APPLICATION INSTITUTE FOR ADVANCED SKIN RESEARCH INC. (JP) 1996-12-04 EP disclosed
US-4258268-A ALDOL CONDENSATIONS PHILLIPS PETROLEUM COMPANY (US) 1981-03-24 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 (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-20060167305-A1 Novel (meth)acrylates and methods of producing thereof MMAB, ADCY1, ME1 CRBN 1036/4885SMN1; SMN2 3840/4885NOS3 981/4885
US-20050215817-A1 Method for producing carboxylic acid ADH1C, HAO2, ALDH2 CRBN 1415/4885SMN1; SMN2 3488/4885NOS3 2860/4885

“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.