SCHEMBL538596

SCHEMBL538596

CC(=O)CC(C)(C)C1CCCCC1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 2/20 0.49
MEN1 O00255 1/20 0.49
ALDH1A1 P00352 1/20 0.49
LMNA P02545 1/20 0.49
ALOX12 P18054 1/20 0.49
KMT2A Q03164 1/20 0.49
NPSR1 Q6W5P4 1/20 0.49
EPHX1 P07099 3/20 0.36
SSTR4 P31391 2/20 0.35
HSD17B10 Q99714 1/20 0.34
CES2 O00748 1/20 0.32
CES1 P23141 1/20 0.32
L3MBTL1 Q9Y468 1/20 0.32
PDK1 Q15118 1/20 0.32
PDK2 Q15119 1/20 0.32
PDK3 Q15120 1/20 0.32
PDK4 Q16654 1/20 0.32
EPHX2 P34913 1/20 0.31
CHRM2 P08172 2/20 0.30
CHRM4 P08173 2/20 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
SCHEMBL15492445 0.89 ALDH1A1 (0.37) SMN1; SMN2MEN1ALDH1A1LMNAALOX12
SCHEMBL11117598 0.83 LIPA (0.42) SMN1; SMN2MEN1ALDH1A1LMNAALOX12
SCHEMBL12996988 0.78 SMN1; SMN2 (0.41) SMN1; SMN2MEN1ALDH1A1LMNAALOX12
SCHEMBL22111281 0.78 KMT2A (0.45) SMN1; SMN2MEN1ALDH1A1LMNAALOX12
SCHEMBL17238842 0.76 TET2 (0.46) SMN1; SMN2MEN1ALDH1A1LMNAALOX12
SCHEMBL13997926 0.75 SMN1; SMN2 (0.39) SMN1; SMN2MEN1ALDH1A1LMNAALOX12
SCHEMBL13997881 0.75 SMN1; SMN2 (0.39) SMN1; SMN2MEN1ALDH1A1LMNAALOX12
SCHEMBL6483909 0.75 KMT2A (0.41) SMN1; SMN2MEN1ALDH1A1LMNAALOX12
SCHEMBL28753364 0.75 ALDH1A1 (0.36) SMN1; SMN2MEN1ALDH1A1LMNAALOX12
SCHEMBL4639751 0.74 SMN1; SMN2 (0.39) SMN1; SMN2MEN1ALDH1A1LMNAALOX12

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 302 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3006547-B1 FRAGRANCE-CONTAINING CAPSULE AND COSMETIC IN WHICH SAID CAPSULES ARE BLENDED SHISEIDO CO LTD (JP) 2019-10-30 EP claimed
US-20160106637-A1 FRAGRANCE-CONTAINING CAPSULE AND COSMETIC IN WHICH SAID CAPSULES ARE BLENDED SHISEIDO COMPANY, LTD. (JP) 2016-04-21 US claimed
EP-3006547-A1 FRAGRANCE-CONTAINING CAPSULE AND COSMETIC IN WHICH SAID CAPSULES ARE BLENDED Shiseido Company Ltd. (JP) 2016-04-13 EP claimed
EP-2020225-B1 Fragrance composition KAO CORP (JP) 2014-10-08 EP claimed
EP-2020225-A2 Fragrance composition Kao Corporation (JP) 2009-02-04 EP claimed
US-7332462-B2 Malodor counteractant compounds GIVAUDAN SA (CH) 2008-02-19 US claimed
US-7288507-B2 Malodor counteractant compounds GIVAUDAN SA (CH) 2007-10-30 US claimed
US-20070116655-A1 MALODOR COUNTERACTANT COMPOUNDS GIVAUDAN SA (CH) 2007-05-24 US claimed
US-20060034789-A1 Malodor counteractant compounds GIVAUDAN SA (CH) 2006-02-16 US claimed
US-20050245407-A1 Fragrance composition KAO CORPORATION (JP) 2005-11-03 US claimed
EP-1552814-A1 FRAGRANCE COMPOSITION Kao Corporation (JP) 2005-07-13 EP claimed
US-20040248762-A1 Malodor counteractant compositions MCGEE THOMAS (US) 2004-12-09 US claimed
EP-1345883-A1 MALODOR COUNTERACTANT COMPOSITIONS Givaudan SA (CH) 2003-09-24 EP claimed
US-20030008787-A1 Malodor counteractant compositions GIVAUDAN SA 2003-01-09 US claimed
WO-2002051788-A1 MALODOR COUNTERACTANT COMPOSITIONS GIVAUDAN SA (CH) 2002-07-04 WO claimed
US-4009253-A 4-CYCLOHEXYL-4-METHYL-2-PENTANONE USEFUL AS A MALODOR COUNTERACTANT MONSANTO COMPANY (US) 1977-02-22 US claimed
EP-4687810-A1 PREPARATIONS COMPRISING HYDROXY PINACOLONE RETINOATE Symrise AG (DE) 2026-02-11 EP disclosed
US-12416114-B2 Fabric spray containing lactilol for malodour reduction CONIPCO, INC. (US) 2025-09-16 US disclosed
US-4009253-A 4-CYCLOHEXYL-4-METHYL-2-PENTANONE USEFUL AS A MALODOR COUNTERACTANT MONSANTO COMPANY (US) 1977-02-22 US disclosed
US-4009253-A 4-CYCLOHEXYL-4-METHYL-2-PENTANONE USEFUL AS A MALODOR COUNTERACTANT MONSANTO COMPANY (US) 1977-02-22 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 (3 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-20040248762-A1 Malodor counteractant compositions MAL2, OPRM1, OR51E2 SMN1; SMN2 502/4885MEN1 1574/4885ALDH1A1 408/4885
US-20060034789-A1 Malodor counteractant compounds MAL2, OR51E2, OPRM1 SMN1; SMN2 732/4885MEN1 1359/4885ALDH1A1 324/4885
US-20070116655-A1 MALODOR COUNTERACTANT COMPOUNDS MAL2, OR51E2, OPRM1 SMN1; SMN2 775/4885MEN1 1275/4885ALDH1A1 485/4885

“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.