SCHEMBL2909459

SCHEMBL2909459

CC(CCC(O)C(C)(C)C)C1CCCCC1

nearest known ligand 0.36

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ TP53 P04637 1/20 0.36
▸ KDM4E B2RXH2 2/20 0.35
▸ GMNN O75496 1/20 0.35
▸ LMNA P02545 1/20 0.35
▸ MAPT P10636 1/20 0.35
▸ BLM P54132 1/20 0.35
▸ PMP22 Q01453 1/20 0.35
▸ SMN1; SMN2 Q16637 1/20 0.35
▸ SHBG P04278 1/20 0.34
▸ TSHR P16473 1/20 0.33
▸ DPP4 P27487 7/20 0.32
▸ EPHX1 P07099 1/20 0.30
▸ DPP7 Q9UHL4 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
SCHEMBL5185800 0.82 TP53 (0.47) TP53KDM4EGMNNLMNAMAPT
SCHEMBL175125 0.79 TP53 (0.41) TP53KDM4EGMNNLMNAMAPT
SCHEMBL12321734 0.79 TP53 (0.41) TP53KDM4EGMNNLMNAMAPT
SCHEMBL21155241 0.77 TP53 (0.38) TP53KDM4EGMNNLMNAMAPT
SCHEMBL170961 0.77 SHBG (0.39) TP53KDM4EGMNNLMNAMAPT
SCHEMBL12321190 0.76 TP53 (0.43) TP53KDM4EGMNNLMNAMAPT
SCHEMBL12321238 0.76 TP53 (0.43) TP53KDM4EGMNNLMNAMAPT
SCHEMBL12321179 0.76 TP53 (0.43) TP53KDM4EGMNNLMNAMAPT
SCHEMBL26105785 0.74 SHBG (0.42) TP53KDM4EGMNNLMNAMAPT
SCHEMBL5541917 0.73 SHBG (0.41) TP53KDM4EGMNNLMNAMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1921129-B1 PERFUME COMPOSITION KAO CORP (JP) 2014-03-12 — — EP disclosed
US-7902142-B2 Fragrance composition KAO CORPORATION (JP) 2011-03-08 — — US disclosed
EP-1555261-B1 VALEROLACTONE COMPOUNDS AND PERFUME COMPOSITION KAO CORP (JP) 2010-09-01 — — EP disclosed
US-20090123404-A1 FRAGRANCE COMPOSITION KAO CORPORATION (JP) 2009-05-14 — — US disclosed
US-7491833-B2 Valerolactone compounds and perfume composition KAO CORPORATION (JP) 2009-02-17 — — US disclosed
EP-1921129-A1 PERFUME COMPOSITION Kao Corporation (JP) 2008-05-14 — — EP disclosed
US-20060258559-A1 Valerolactone compounds and perfume composition KAO CORPORATION (JP) 2006-11-16 — — US disclosed
EP-1555261-A1 VALEROLACTONE COMPOUNDS AND PERFUME COMPOSITION Kao Corporation (JP) 2005-07-20 — — 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-20090123404-A1 FRAGRANCE COMPOSITION NAA40, FAAH, TAS1R1 TP53 3393/4885KDM4E 2048/4885GMNN 3392/4885

“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.

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