SCHEMBL345668

SCHEMBL345668

CC(C)(CO)C1CCCC1

nearest known ligand 0.39

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 2/20 0.39
MEN1 O00255 1/20 0.39
ALDH1A1 P00352 1/20 0.39
LMNA P02545 1/20 0.39
ALOX12 P18054 1/20 0.39
KMT2A Q03164 1/20 0.39
NPSR1 Q6W5P4 1/20 0.39
CES2 O00748 1/20 0.32
HSD17B10 Q99714 1/20 0.31
KDM4E B2RXH2 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
SCHEMBL4681944 0.97 SMN1; SMN2 (0.42) SMN1; SMN2MEN1ALDH1A1LMNAALOX12
SCHEMBL17859041 0.88
SCHEMBL20334802 0.82 MEN1 (0.34) SMN1; SMN2MEN1ALDH1A1LMNAALOX12
SCHEMBL20334661 0.80
SCHEMBL26109640 0.79 SHBG (0.34) CES2
SCHEMBL15360815 0.79 CES2 (0.31) CES2
SCHEMBL8850626 0.78 SMN1; SMN2 (0.32) SMN1; SMN2MEN1ALDH1A1LMNAALOX12
SCHEMBL24750369 0.77
SCHEMBL13713730 0.77 KDM4E (0.38) ALDH1A1KDM4E
SCHEMBL2777672 0.77 MEN1 (0.40) 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 27 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0404470-B1 Fragrance compositions and their use in detergent products QUEST INT (NL) 1994-04-13 EP claimed
EP-0147191-B1 PERFUME AND COMPOSITIONS CONTAINING PERFUME UNILEVER N.V. (NL) 1989-10-04 EP claimed
EP-3209267-B1 IMPROVED ANTITRANSPIRANTS HENKEL AG & CO KGAA (DE) 2018-11-28 EP disclosed
EP-3274055-A1 COSMETIC PREPARATIONS WITH LOW TEXTILE ADHESION Henkel AG & Co. KGaA (DE) 2018-01-31 EP disclosed
EP-2349185-B1 MORE EFFECTIVE ANHYDROUS DEODORANT COMPOSITIONS APPLIED AS AN AEROSOL HENKEL AG & CO KGAA (DE) 2018-01-24 EP disclosed
EP-3027167-B1 WATER FREE OIL/THICKENER-MIXTURES AS BASE FOR COSMETIC SOFT, SOLID- OR STICKPREPARATIONS HENKEL AG & CO KGAA (DE) 2017-08-09 EP disclosed
EP-2931224-B1 ANHYDROUS COMPOSITIONS ACTIVE AGAINST BODY ODOURS HENKEL AG & CO KGAA (DE) 2017-06-28 EP disclosed
EP-2994089-B1 AEROSOL COMPOSITION HAVING IMPROVED SPRAYING PROPERTIES HENKEL AG & CO KGAA (DE) 2017-03-15 EP disclosed
EP-2413889-B1 WATER-FREE ANTIPERSPIRANT SPRAYS WITH IMPROVED ACTIVE SUBSTANCE RELEASE HENKEL AG & CO KGAA (DE) 2016-11-09 EP disclosed
WO-2016150671-A1 COSMETIC PREPARATIONS WITH LOW TEXTILE ADHESION HENKEL AG & CO. KGAA (DE) 2016-09-29 WO disclosed
EP-2224897-B1 WATER-FREE ANTIPERSPIRANT SPRAYS WITH IMPROVED SUBSTANCE RELEASE HENKEL AG & CO KGAA (DE) 2016-08-17 EP disclosed
US-20120020906-A1 ANTIPERSPIRANT SPRAYS WITH ESTER OILS HENKEL AG & CO. KGAA (DE) 2012-01-26 US disclosed
US-20120014897-A1 WATER-FREE ANTIPERSPIRANT SPRAYS WITH IMPROVED SUBSTANCE RELEASE HENKEL AG & CO. KGAA (DE) 2012-01-19 US disclosed
EP-2349185-A2 MORE EFFECTIVE ANHYDROUS DEODORANT COMPOSITIONS APPLIED AS A SPRAY Henkel AG & Co. KGaA (DE) 2011-08-03 EP disclosed
EP-2349184-A2 MORE EFFECTIVE ANHYDROUS DEODORANT COMPOSITIONS APPLIED AS A NON-AEROSOL Henkel AG & Co. KGaA (DE) 2011-08-03 EP disclosed
US-20100260698-A1 Anhydrous Antiperspirant Compositions with Improved Active Substance Release HENKEL AG & CO. KGAA (DE) 2010-10-14 US disclosed
WO-2010009976-A2 MORE EFFECTIVE ANHYDROUS DEODORANT COMPOSITIONS APPLIED AS A NON-AEROSOL HENKEL AG & CO. KGAA (DE) 2010-01-28 WO disclosed
WO-2010009977-A2 MORE EFFECTIVE ANHYDROUS DEODORANT COMPOSITIONS APPLIED AS A SPRAY HENKEL AG & CO. KGAA (DE) 2010-01-28 WO disclosed
US-20080124282-A1 Oil-containing deodorizing aerosol compositions having skin-cooling active substances HENKEL KOMMANDITGESELLSCHAFT AUF AKTIEN (DE) 2008-05-29 US disclosed
EP-1430880-A2 Alcohol free deodorant spray containing skin cooling active agents Hans Schwarzkopf & Henkel GmbH & Co. KG (DE) 2004-06-23 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 (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-20120020906-A1 ANTIPERSPIRANT SPRAYS WITH ESTER OILS CUTA, NAPEPLD, LIPE SMN1; SMN2 3378/4885MEN1 2309/4885ALDH1A1 1032/4885
US-20100260698-A1 Anhydrous Antiperspirant Compositions with Improved Active Substance Release CUTA, CYP2W1, IDUA SMN1; SMN2 2841/4885MEN1 4198/4885ALDH1A1 526/4885
US-20120014897-A1 WATER-FREE ANTIPERSPIRANT SPRAYS WITH IMPROVED SUBSTANCE RELEASE POLR1C, CTRL, CUTA SMN1; SMN2 4670/4885MEN1 2444/4885ALDH1A1 2525/4885

“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.