SCHEMBL7054062

SCHEMBL7054062

CCCCCC1=CCCC(=O)O1

nearest known ligand 0.34

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 3/20 0.34
CDC25A P30304 6/20 0.33
CDC25B P30305 6/20 0.33
CDC25C P30307 5/20 0.33
ACHE P22303 1/20 0.33
BACE1 P56817 1/20 0.33
ALOX15 P16050 1/20 0.31
GPR84 Q9NQS5 3/20 0.31
KMT2A Q03164 1/20 0.30
CYP1A1 P04798 1/20 0.30
TSHR P16473 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
SCHEMBL704205 0.81 ACHE (0.34) CYP1A2CDC25ACDC25BCDC25CACHE
SCHEMBL13176405 0.81
SCHEMBL3021386 0.80 ACHE (0.37) CYP1A2CDC25ACDC25BCDC25CACHE
SCHEMBL4629705 0.80 ACHE (0.37) CYP1A2CDC25ACDC25BCDC25CACHE
SCHEMBL2315804 0.80 ACHE (0.37) CYP1A2CDC25ACDC25BCDC25CACHE
SCHEMBL6711886 0.77
SCHEMBL3171947 0.74 ALDH1A1 (0.35) ALOX15
SCHEMBL11156027 0.73 ACHE (0.37) CDC25ACDC25BCDC25CACHEBACE1
SCHEMBL19679874 0.72
SCHEMBL19679879 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 11 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6639089-B2 Therapy, side effect reduction SODA AROMATIC CO., LTD. 2003-10-28 US claimed
US-20030055105-A1 Anticancer agents, perfumes or foods and drinks containing omega-hydroxyfatty acids SODA AROMATIC CO., LTD. A JAPANESE CORPORATION (JP) 2003-03-20 US claimed
EP-1249236-A1 ANTICANCER AGENTS, PERFUMES OR FOODS AND DRINKS CONTAINING $g(v)-HYDROXYFATTY ACIDS SODA AROMATIC COMPANY, LIMITED (JP) 2002-10-16 EP claimed
US-6639089-B2 Therapy, side effect reduction SODA AROMATIC CO., LTD. 2003-10-28 US disclosed
US-20030055105-A1 Anticancer agents, perfumes or foods and drinks containing omega-hydroxyfatty acids SODA AROMATIC CO., LTD. A JAPANESE CORPORATION (JP) 2003-03-20 US disclosed
CN-1394139-A Anticancer agents SODA AROMATIC (JP) 2003-01-29 CN disclosed
EP-1249236-A1 ANTICANCER AGENTS, PERFUMES OR FOODS AND DRINKS CONTAINING $g(v)-HYDROXYFATTY ACIDS SODA AROMATIC COMPANY, LIMITED (JP) 2002-10-16 EP disclosed
US-6028033-A FOR CONTROLLING UNDESIRED VEGETATION BASF AKTIENGESELLSCHAFT (DE) 2000-02-22 US disclosed
EP-0412880-B1 Process for the microbiological production of gamma and delta lactones PERNOD RICARD (FR) 1995-11-22 EP disclosed
US-5168054-A From oxidized unsaturated fatty acids PERNOD-RICARD (FR) 1992-12-01 US disclosed
EP-0412880-A2 Process for the microbiological production of gamma and delta lactones PERNOD-RICARD (FR) 1991-02-13 EP 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-20030055105-A1 Anticancer agents, perfumes or foods and drinks containing omega-hydroxyfatty acids ALOX5, ELOVL5, ELOVL3 CYP1A2 640/4885CDC25A 814/4885CDC25B 1295/4885

“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.