SCHEMBL23923515

SCHEMBL23923515

C=C(C)C(CC=C(C)C)COC(=O)C=CC

nearest known ligand 0.35

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
GRIK1 P39086 1/20 0.35
GRIK2 Q13002 1/20 0.35
TSHR P16473 1/20 0.33
PTGS1 P23219 1/20 0.31
GSTP1 P09211 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
SCHEMBL23923513 1.00 GRIK1 (0.35) GRIK1GRIK2TSHRPTGS1GSTP1
SCHEMBL23923698 0.85 ALDH1A1 (0.36) GRIK1GRIK2TSHRPTGS1
SCHEMBL23923700 0.85 ALDH1A1 (0.36) GRIK1GRIK2TSHRPTGS1
SCHEMBL9323590 0.84 TSHR (0.50) GRIK1GRIK2TSHRPTGS1
SCHEMBL14856833 0.84 GRIK1 (0.37) GRIK1GRIK2TSHRPTGS1
SCHEMBL336388 0.84 GRIK1 (0.37) GRIK1GRIK2TSHRPTGS1
SCHEMBL132576 0.82 GRIK1 (0.40) GRIK1GRIK2TSHRPTGS1
SCHEMBL1302324 0.82 GRIK1 (0.40) GRIK1GRIK2TSHRPTGS1
SCHEMBL23923567 0.79 TSHR (0.37) GRIK1GRIK2TSHR
SCHEMBL23923568 0.79 TSHR (0.37) GRIK1GRIK2TSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-113527079-B Method for preparing 2-isopropenyl-5-methyl-4-hexenoic acid and derivative alcohol and carboxylic ester thereof 信越化学工业株式会社 2023-11-14 CN disclosed
EP-3901125-B1 PROCESSES FOR PREPARING 2-ISOPROPENYL-5-METHYL-4-HEXENOIC ACID, 2-ISOPROPENYL-5-METHYL-4-HEXEN-1-OL, AND A CARBOXYLATE ESTER THEREOF SHINETSU CHEMICAL CO (JP) 2023-01-18 EP disclosed
US-11286227-B2 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) 2022-03-29 US disclosed
EP-3901125-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) 2021-10-27 EP disclosed
CN-113527079-A Method for preparing 2-isopropenyl-5-methyl-4-hexenoic acid and derivative alcohol and carboxylic ester thereof 信越化学工业株式会社 2021-10-22 CN disclosed
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 (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-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 GRIK1 13/4885GRIK2 47/4885TSHR 329/4885
US-11286227-B2 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 GRIK1 13/4885GRIK2 47/4885TSHR 329/4885

“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.