SCHEMBL6281963

SCHEMBL6281963

CCCCNC(=O)C(C)(C)NC(C)(C)C

nearest known ligand 0.53

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
EPHX1 P07099 8/20 0.53
ACHE P22303 7/20 0.44
CASP2 P42575 1/20 0.42
MMP2 P08253 1/20 0.42
MEN1 O00255 1/20 0.42
KMT2A Q03164 1/20 0.42
KDM4C Q9H3R0 1/20 0.40
ZDHHC20 Q5W0Z9 1/20 0.40
ZDHHC2 Q9UIJ5 1/20 0.40

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
SCHEMBL2736685 0.79 EPHX1 (0.55) EPHX1ACHEMMP2
SCHEMBL10765973 0.79 EPHX1 (0.55) EPHX1ACHEMMP2
SCHEMBL15235859 0.78 SIGMAR1 (0.39) EPHX1MEN1KMT2A
SCHEMBL25848647 0.77 EPHX1 (0.53) EPHX1ACHEMMP2
SCHEMBL24376776 0.75 EPHX1 (0.68) EPHX1CASP2MEN1KMT2AZDHHC20
SCHEMBL19478069 0.75 EPHX1 (0.68) EPHX1CASP2MEN1KMT2AZDHHC20
SCHEMBL5439873 0.75 EPHX1 (0.68) EPHX1CASP2MEN1KMT2AZDHHC20
SCHEMBL21738174 0.75 EPHX1 (0.68) EPHX1CASP2MEN1KMT2AZDHHC20
SCHEMBL22351756 0.75 EPHX1 (0.52) EPHX1ACHEMMP2
SCHEMBL10251931 0.75 EPHX1 (0.62) EPHX1ACHEMMP2MEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6841703-B2 Open chain alkoxyamine compounds and their use as polymerization regulators CIBA SPECIALTY CHEMICALS CORPORATION (US) 2005-01-11 US disclosed
EP-1100772-B1 OPEN CHAIN ALKOXYAMINE COMPOUNDS AND THEIR USE AS POLYMERIZATION REGULATORS CIBA SC HOLDING AG (CH) 2004-04-14 EP disclosed
US-20030125489-A1 Open chain alkoxyamine compounds and their use as polymerization regulators NESVADBA PETER (CH) 2003-07-03 US disclosed
US-6518326-B1 Open chain alkoxyamine compounds and their use as polymerization regulators CIBA SPECIALTY CHEMICALS CORPORATION 2003-02-11 US disclosed
EP-1100772-A1 OPEN CHAIN ALKOXYAMINE COMPOUNDS AND THEIR USE AS POLYMERIZATION REGULATORS Ciba SC Holding AG (CH) 2001-05-23 EP disclosed
WO-2000007981-A1 OPEN CHAIN ALKOXYAMINE COMPOUNDS AND THEIR USE AS POLYMERIZATION REGULATORS CIBA SPECIALTY CHEMICALS HOLDING INC. (CH) 2000-02-17 WO 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-20030125489-A1 Open chain alkoxyamine compounds and their use as polymerization regulators ALOX5, PTGER1, ALOX12 EPHX1 174/4885ACHE 3080/4885CASP2 3943/4885

“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.