SCHEMBL6286532

SCHEMBL6286532

CCCNC(=O)C(C)(C)NC(C)(C)CO

nearest known ligand 0.43

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
KDM4C Q9H3R0 1/20 0.43
EPHX1 P07099 8/20 0.39
MMP1 P03956 1/20 0.35
MMP2 P08253 1/20 0.35
MMP3 P08254 1/20 0.35
MMP9 P14780 1/20 0.35
MCL1 Q07820 1/20 0.33
KMT2A Q03164 3/20 0.32
MEN1 O00255 2/20 0.32
CNR1 P21554 1/20 0.32
NAAA Q02083 1/20 0.32
POLB P06746 1/20 0.31
GAA P10253 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
SCHEMBL6276757 0.78 FAAH (0.38) KDM4CEPHX1MMP1MMP2MMP3
SCHEMBL12733375 0.75 KDM4C (0.48) KDM4CEPHX1MMP1MMP2MMP3
SCHEMBL621056 0.75 KDM4C (0.44) KDM4CEPHX1MMP1MMP2MMP3
SCHEMBL25027534 0.72 KDM4C (0.50) KDM4CEPHX1MMP1MMP2MMP3
SCHEMBL2293893 0.72 KDM4C (0.48) KDM4CEPHX1MMP1MMP2MMP3
SCHEMBL6281963 0.71 EPHX1 (0.53) KDM4CEPHX1MMP2KMT2AMEN1
SCHEMBL6285315 0.70 KDM4C (0.38) KDM4C
SCHEMBL8237341 0.70 KDM4C (0.47) KDM4CEPHX1MMP1MMP2MMP3
SCHEMBL6286522 0.69 EPHX1 (0.43) KDM4CEPHX1MMP1MMP2MMP3
SCHEMBL10473936 0.69 CA4 (0.33)

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 KDM4C 668/4885EPHX1 174/4885MMP1 2953/4885

“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.