SCHEMBL25779016

SCHEMBL25779016

CCOC(=O)CC(=O)OC(C)C1=CCC(C)(C)CC1

nearest known ligand 0.39

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
MGAM O43451 1/20 0.39
GAA P10253 1/20 0.39
SI P14410 1/20 0.39
MGAM2 Q2M2H8 1/20 0.39
ALOX15 P16050 1/20 0.35
CSF1R P07333 1/20 0.33
LMNA P02545 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
SCHEMBL26625969 0.87 MGAM (0.41) MGAMGAASIMGAM2ALOX15
SCHEMBL25288073 0.82
SCHEMBL30620779 0.82 GAA (0.41) MGAMGAASIMGAM2ALOX15
SCHEMBL31359625 0.67 MGAM (0.46) MGAMGAASIMGAM2ALOX15
SCHEMBL25779014 0.67 MGAM (0.46) MGAMGAASIMGAM2ALOX15
SCHEMBL31359626 0.67 MGAM (0.46) MGAMGAASIMGAM2ALOX15
SCHEMBL27843171 0.66 MMP8 (0.49) MGAMGAASIMGAM2LMNA
SCHEMBL16840132 0.66 PRMT1 (0.38)
SCHEMBL8254860 0.65 PRMT1 (0.38)
SCHEMBL8253157 0.65 PRMT1 (0.38)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230202963-A1 ESTERS AS FRAGRANCE COMPOUNDS SYMRISE AG (DE) 2023-06-29 US disclosed
US-20230202963-A1 ESTERS AS FRAGRANCE COMPOUNDS SYMRISE AG (DE) 2023-06-29 US disclosed
US-20230202963-A1 ESTERS AS FRAGRANCE COMPOUNDS SYMRISE AG (DE) 2023-06-29 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-20230202963-A1 ESTERS AS FRAGRANCE COMPOUNDS CUTA, TRPA1, FASN MGAM 3672/4885GAA 3084/4885SI 958/4885

“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.