SCHEMBL5389048

SCHEMBL5389048

CCC1(c2ccccc2)C(=O)OCC(C)(C)N1[O]

nearest known ligand 0.41

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
MITF O75030 2/20 0.38
MEN1 O00255 2/20 0.38
KMT2A Q03164 2/20 0.38
TSHR P16473 2/20 0.36
CYP1A2 P05177 1/20 0.36
POLB P06746 1/20 0.36
APEX1 P27695 1/20 0.36
TDP1 Q9NUW8 1/20 0.36
CYP2C19 P33261 1/20 0.34
LMNA P02545 4/20 0.33
MPO P05164 1/20 0.33
BACE1 P56817 2/20 0.33
BACE2 Q9Y5Z0 1/20 0.33
ALDH1A1 P00352 2/20 0.33
TP53 P04637 1/20 0.32
HCAR3 P49019 1/20 0.32
HCAR2 Q8TDS4 1/20 0.32
HSD11B1 P28845 1/20 0.32
ELANE P08246 1/20 0.32

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
SCHEMBL5389053 0.84 MEN1 (0.40) MITFMEN1KMT2ATSHRCYP1A2
SCHEMBL5396632 0.78 MPO (0.36) MPOBACE1BACE2ALDH1A1HSD11B1
SCHEMBL5396081 0.76 MITF (0.34) MITFMEN1KMT2AHSD11B1
SCHEMBL3123580 0.72
SCHEMBL7073909 0.71
SCHEMBL5396638 0.68 ALDH1A1 (0.34) MEN1KMT2ATSHRCYP1A2CYP2C19
SCHEMBL576540 0.67 BRD4 (0.41) MEN1KMT2ACYP1A2TDP1ALDH1A1
SCHEMBL6304953 0.66 CHRNB2 (0.36) MEN1KMT2ATSHRCYP1A2LMNA
SCHEMBL5410307 0.66 MPO (0.30) MPO
SCHEMBL19923592 0.66 MITF (0.42) MITFMEN1KMT2ATSHRCYP2C19

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7297819-B2 Open-chain alkoxyamines and their corresponding nitroxides for controlled low temperature radical polymerization CIBA SPECIALTY CHEMICALS CORP. (US) 2007-11-20 US disclosed
EP-1481012-B1 OPEN-CHAIN ALKOXYAMINES AND THEIR CORRESPONDING NITROXIDES FOR CONTROLLED LOW TEMPERATURE RADICAL POLYMERIZATION CIBA SC HOLDING AG (CH) 2006-05-17 EP disclosed
US-20050124814-A1 Open-chain alkoxyamines and their corresponding nitroxides for controlled low temperature radical polymerization CIBA SPECIALTY CHEMICALS CORPORATION 2005-06-09 US disclosed
EP-1481012-A1 OPEN-CHAIN ALKOXYAMINES AND THEIR CORRESPONDING NITROXIDES FOR CONTROLLED LOW TEMPERATURE RADICAL POLYMERIZATION Ciba SC Holding AG (CH) 2004-12-01 EP disclosed
WO-2003074572-A1 OPEN-CHAIN ALKOXYAMINES AND THEIR CORRESPONDING NITROXIDES FOR CONTROLLED LOW TEMPERATURE RADICAL POLYMERIZATION CIBA SPECIALTY CHEMICALS HOLDING INC. (CH) 2003-09-12 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-20050124814-A1 Open-chain alkoxyamines and their corresponding nitroxides for controlled low temperature radical polymerization ALOX5, NOS2, NOS1 MITF 4433/4885MEN1 4634/4885KMT2A 2644/4885

“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.