SCHEMBL4814404

SCHEMBL4814404

CCCC1(C(=O)OCC(C)C)CCCC1OC(C)=O

nearest known ligand 0.36

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
AKT1 P31749 10/20 0.36
RAB9A P51151 1/20 0.32
TSHR P16473 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
SCHEMBL4807688 0.92 AKT1 (0.41) AKT1RAB9A
SCHEMBL4813037 0.91 AKT1 (0.45) AKT1RAB9A
SCHEMBL4810951 0.90 AKT1 (0.47) AKT1
SCHEMBL4812957 0.90 AKT1 (0.32) AKT1RAB9ATSHR
SCHEMBL4817340 0.89 RAB9A (0.33) AKT1RAB9ATSHR
SCHEMBL4810499 0.88 AKT1 (0.45) AKT1
SCHEMBL4813800 0.86 RAB9A (0.33) RAB9ATSHR
SCHEMBL4808452 0.85 AKT1 (0.35) AKT1
SCHEMBL4805220 0.83 AKT1 (0.40) AKT1
SCHEMBL4814593 0.81 LMNA (0.37) RAB9ATSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7388103-B2 Cyclopentane carboxylate compounds, process and intermediates for preparing the same and use thereof CHINA PETROLEUM & CHEMICAL CORPORATION (CN) 2008-06-17 US disclosed
US-20060094843-A1 Cyclopentane carboxylate compounds, process and intermediates for preparing the same and use thereof CHINA PETROLEUM & CHEMICAL CORPORATION (CN) 2006-05-04 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-20060094843-A1 Cyclopentane carboxylate compounds, process and intermediates for preparing the same and use thereof C5, C1S, AKR1C3 AKT1 1995/4885RAB9A 3676/4885TSHR 4305/4885

“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.