SCHEMBL856250

SCHEMBL856250

CCOC(=O)C(Cc1ccccc1)C(C)=O

nearest known ligand 0.69

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MMP8 P22894 1/20 0.69
ALDH1A1 P00352 3/20 0.57
TP53 P04637 1/20 0.57
NPY1R P25929 1/20 0.56
NPY2R P49146 1/20 0.56
PKM P14618 2/20 0.53
TDP1 Q9NUW8 2/20 0.50
MDM2 Q00987 1/20 0.49
PIN1 Q13526 1/20 0.47
EPHX2 P34913 1/20 0.47
PPARG P37231 1/20 0.47
MEN1 O00255 1/20 0.46
NPC1 O15118 1/20 0.46
KMT2A Q03164 1/20 0.46
L3MBTL1 Q9Y468 4/20 0.46
SMN1; SMN2 Q16637 1/20 0.46
ALPI P09923 1/20 0.46
PTGS1 P23219 1/20 0.46
XIAP P98170 1/20 0.46
SLC7A5 Q01650 1/20 0.46

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
SCHEMBL28250166 0.97 MMP8 (0.66) MMP8ALDH1A1TP53NPY1RNPY2R
SCHEMBL165382 0.91 MMP8 (0.76) MMP8ALDH1A1TP53NPY1RNPY2R
SCHEMBL8719475 0.91 MMP8 (0.58) MMP8ALDH1A1TP53NPY1RNPY2R
SCHEMBL467987 0.89 MMP8 (0.73) MMP8ALDH1A1TP53NPY1RNPY2R
SCHEMBL4855268 0.87 LMNA (0.62) MMP8ALDH1A1PPARGL3MBTL1PTGS1
SCHEMBL2050344 0.86 MMP8 (0.53) MMP8ALDH1A1TP53NPY1RNPY2R
SCHEMBL5326604 0.86 MMP8 (0.53) MMP8ALDH1A1TP53NPY1RNPY2R
SCHEMBL22507577 0.86 ALDH1A1 (0.59) MMP8ALDH1A1PKMTDP1MDM2
SCHEMBL26757664 0.86 ALDH1A1 (0.59) MMP8ALDH1A1PKMTDP1MDM2
SCHEMBL28682225 0.86 MMP8 (0.69) MMP8ALDH1A1TP53NPY1RNPY2R

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-116715976-A Chiral carbon-containing pentamethine cyanine dye, and preparation method and application thereof 大连理工大学 2023-09-08 CN claimed
EP-3809876-A1 PROTECTIVE AGENT FOR FOOD PRODUCTS AND THE LIKE AND FOR CURING AND/OR STORAGE ROOMS OF THE SAME PERPRIN S.R.L. (IT) 2021-04-28 EP claimed
WO-2019243869-A1 PROTECTIVE AGENT FOR FOOD PRODUCTS AND THE LIKE AND FOR CURING AND/OR STORAGE ROOMS OF THE SAME PERPRIN S.R.L. (IT) 2019-12-26 WO claimed
CN-103553914-A Phenylethyl acetate synthesis method JI XUELIANG 2014-02-05 CN claimed
JP-4739231-B2 2011-08-03 JP claimed
EP-1716159-B1 BICYCLIC SILOXANE COMPOSITIONS FOR THE RELEASE OF ACTIVE INGREDIENTS MOMENTIVE PERFORMANCE MAT INC (US) 2011-07-13 EP claimed
WO-2009131692-A1 SUBSTRATES FOR DELIVERY OF PHYSIOLOGICALLY ACTIVE AGENTS THE BOARD OF TRUSTEES OF THE UNIVERSITY OF ALABAMA (US) 2009-10-29 WO claimed
US-7579495-B2 Active-releasing cyclic siloxanes MOMENTIVE PERFORMANCE MATERIALS INC. (US) 2009-08-25 US claimed
US-7576170-B2 Cyclic siloxane compositions for the release of active ingredients MOMENTIVE PERFORMANCE MATERIALS (US) 2009-08-18 US claimed
CN-100522127-C Perfume composition KAO CORP (JP) 2009-08-05 CN claimed
EP-1697386-B1 ACTIVE INGREDIENT-RELEASING CYCLIC SILOXANES GEN ELECTRIC (US) 2007-10-10 EP claimed
US-7141694-B2 Enzymatic resolution of aryl and thio-substituted acids BRISTOL-MYERS SQUIBB COMPANY (US) 2006-11-28 US claimed
EP-1716159-A2 CYCLIC SILOXANE COMPOSITIONS FOR THE RELEASE OF ACTIVE INGREDIENTS General Electronic Company (US) 2006-11-02 EP claimed
EP-1697386-A1 ACTIVE INGREDIENT-RELEASING CYCLIC SILOXANES General Electric Company A Corporation of the State of New York (US) 2006-09-06 EP claimed
WO-2005066187-A1 ACTIVE INGREDIENT-RELEASING CYCLIC SILOXANES GENERAL ELECTRIC COMPANY (US) 2005-07-21 WO claimed
WO-2005066186-A2 CYCLIC SILOXANE COMPOSITIONS FOR THE RELEASE OF ACTIVE INGREDIENTS GENERAL ELECTRIC COMPANY (US) 2005-07-21 WO claimed
US-20050136022-A1 Cyclic siloxane compositions for the release of active ingredients MOMENTIVE PERFORMANCE MATERIALS INC. 2005-06-23 US claimed
US-20050136021-A1 Active-releasing cyclic siloxanes MOMENTIVE PERFORMANCE MATERIALS INC. 2005-06-23 US claimed
JP-11116506-A None JP disclosed
US-4156016-A ANTICOAGULANTS HOFFMANN-LA ROCHE INC. (US) 1979-05-22 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 (2 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-20050136022-A1 Cyclic siloxane compositions for the release of active ingredients F9, RPL39, ECPAS MMP8 904/4885ALDH1A1 44/4885TP53 3004/4885
US-20050136021-A1 Active-releasing cyclic siloxanes F9, RPL39, ALDH16A1 MMP8 322/4885ALDH1A1 57/4885TP53 3506/4885

“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.