SCHEMBL23937333

SCHEMBL23937333

CCC(C)C(=O)OCC(C)CC=C(C)C

nearest known ligand 0.38

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
ALOX15 P16050 1/20 0.38
MAPT P10636 1/20 0.33
GRIK1 P39086 1/20 0.32
GRIK2 Q13002 1/20 0.32
FNTA P49354 1/20 0.30
FNTB P49356 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
SCHEMBL1350008 0.80 GRIK1 (0.35) ALOX15GRIK1GRIK2
SCHEMBL1351737 0.80 GRIK1 (0.35) ALOX15GRIK1GRIK2
SCHEMBL1348778 0.80 GRIK1 (0.35) ALOX15GRIK1GRIK2
SCHEMBL1349870 0.80 GRIK1 (0.35) ALOX15GRIK1GRIK2
SCHEMBL1351637 0.80 GRIK1 (0.35) ALOX15GRIK1GRIK2
SCHEMBL8954807 0.78 MAPT (0.47) MAPT
SCHEMBL8954811 0.78 MAPT (0.47) MAPT
SCHEMBL1172359 0.78 MAPT (0.47) MAPT
SCHEMBL28249353 0.76 MAPT (0.37) ALOX15MAPT
SCHEMBL14322287 0.76 TSHR (0.44) ALOX15MAPTGRIK1GRIK2FNTA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20210323902-A1 PROCESSES FOR PREPARING 2-ISOPROPENYL-5-METHYL-4-HEXENOIC ACID, 2-ISOPROPENYL-5-METHYL-4-HEXEN-1-OL, AND A CARBOXYLATE ESTER THEREOF SHIN-ETSU CHEMICAL CO., LTD. (JP) 2021-10-21 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-20210323902-A1 PROCESSES FOR PREPARING 2-ISOPROPENYL-5-METHYL-4-HEXENOIC ACID, 2-ISOPROPENYL-5-METHYL-4-HEXEN-1-OL, AND A CARBOXYLATE ESTER THEREOF IGF1R, HPD, IGF2R ALOX15 174/4885MAPT 4720/4885GRIK1 13/4885

“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.