SCHEMBL506194

SCHEMBL506194

CC1(C)CCCC(C)(C)C1=O

nearest known ligand 0.41

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
ACHE P22303 1/20 0.41
POLB P06746 1/20 0.32
LIG1 P18858 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
SCHEMBL3129262 0.93 ACHE (0.37) ACHEPOLB
SCHEMBL2692984 0.86 KDM4E (0.31) ACHE
SCHEMBL1244972 0.81 ACHE (0.35) ACHEPOLB
SCHEMBL25973786 0.81 ACHE (0.35) ACHE
SCHEMBL966903 0.80 ACHE (0.41) ACHEPOLB
SCHEMBL2458387 0.78 ACHE (0.40) ACHEPOLB
SCHEMBL7548140 0.78 ACHE (0.40) ACHEPOLB
SCHEMBL21001390 0.75 ACHE (0.36) ACHE
SCHEMBL21001214 0.75 ACHE (0.32) ACHE
SCHEMBL8594481 0.75 ACHE (0.39) ACHEPOLB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3049455-B1 NEW CROSSLINKERS FOR COATING COMPOUNDS BASF SE (DE) 2020-11-25 EP claimed
US-10227504-B2 Crosslinkers for coating compounds BASF SE (DE) 2019-03-12 US claimed
US-20170226064-A1 Synthesis of Triethylenetetramines PHILERA NEW ZEALAND LIMITED (NZ) 2017-08-10 US claimed
US-20160237310-A1 NEW CROSSLINKERS FOR COATING COMPOUNDS BASF SE (DE) 2016-08-18 US claimed
EP-3049455-A1 NEW CROSSLINKERS FOR COATING COMPOUNDS BASF SE (DE) 2016-08-03 EP claimed
US-20160102060-A1 Synthesis of Triethylenetetramines PROTEMIX CORPORATION LIMITED (NZ) 2016-04-14 US claimed
WO-2015043894-A1 NEW CROSSLINKERS FOR COATING COMPOUNDS BASF SE (DE) 2015-04-02 WO claimed
US-20060167281-A1 1,2,4- Trioxepanes as precursors for lactones AKZO NOBEL N.V. (NL) 2006-07-27 US claimed
EP-1646618-A1 1,2,4,-TRIOXEPANES AS PRECURSORS FOR LACTONES Akzo Nobel N.V. (NL) 2006-04-19 EP claimed
WO-2005014569-A1 1,2,4,-TRIOXEPANES AS PRECURSORS FOR LACTONES AKZO NOBEL N.V. (NL) 2005-02-17 WO claimed
JP-61189241-A None JP disclosed
EP-4615896-A1 SCRATCH RESISTANT ONE-PACK COATING MATERIAL BASF Coatings GmbH (DE) 2025-09-17 EP disclosed
US-20240209140-A1 HYDROXYL-FUNCTIONAL THIOETHER COMPOUNDS AND THEIR USE IN CURABLE COMPOSITIONS BASF COATINGS GMBH (DE) 2024-06-27 US disclosed
WO-2024100307-A1 SCRATCH RESISTANT ONE-PACK COATING MATERIAL BASF COATINGS GMBH (DE) 2024-05-16 WO disclosed
EP-4368648-A1 ALKOXYSILANE-BASED CROSSLINKING AGENT BASF Coatings GmbH (DE) 2024-05-15 EP disclosed
US-4454328-A SWEETENERS PFIZER INC. (US) 1984-06-12 US disclosed
US-4411925-A STABLE SWEETENERS PFIZER INC. (US) 1983-10-25 US disclosed
US-4399163-A ARTIFICIAL SWEETENERS PFIZER INC. (US) 1983-08-16 US disclosed
EP-0069811-A1 Branched amides of L-aspartyl-D-amino acid dipeptides and compositions thereof PFIZER INC. (US) 1983-01-19 EP disclosed
EP-0034876-A2 Branched amides of L-aspartyl-D-amino acid dipeptides and compositions thereof PFIZER INC. (US) 1981-09-02 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-20160102060-A1 Synthesis of Triethylenetetramines PNMT, TES, TPR ACHE 1513/4885POLB 1118/4885LIG1 2471/4885
US-20170226064-A1 Synthesis of Triethylenetetramines PNMT, TES, TPR ACHE 1513/4885POLB 1118/4885LIG1 2471/4885
US-20060167281-A1 1,2,4- Trioxepanes as precursors for lactones CYP4X1, LSS, RIOX2 ACHE 1023/4885POLB 4619/4885LIG1 3380/4885

“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.