SCHEMBL4887032

SCHEMBL4887032

CC(C)(Br)C(=O)OCCOC(=O)CCN1C(=O)C=CC1=O

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.42
HPGD P15428 2/20 0.42
CYP1A2 P05177 1/20 0.42
CYP2C19 P33261 1/20 0.42
BLM P54132 1/20 0.42
WRN Q14191 1/20 0.42
HIF1A Q16665 1/20 0.42
GSK3A P49840 2/20 0.41
GSK3B P49841 2/20 0.41
MGLL Q99685 5/20 0.40
PTGS1 P23219 7/20 0.38
PTGS2 P35354 7/20 0.38
MAPK1 P28482 2/20 0.37
NPSR1 Q6W5P4 2/20 0.37
POLB P06746 1/20 0.37
GAA P10253 1/20 0.37
MAPT P10636 2/20 0.36
RECQL P46063 2/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
FAAH O00519 3/20 0.36

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
SCHEMBL14922154 0.91 NPSR1 (0.47) ALDH1A1HPGDCYP1A2CYP2C19BLM
SCHEMBL7098396 0.87 MGLL (0.50) ALDH1A1HPGDCYP1A2CYP2C19BLM
SCHEMBL17662840 0.85 MGLL (0.50) ALDH1A1HPGDCYP1A2CYP2C19BLM
SCHEMBL13260919 0.83 MGLL (0.62) ALDH1A1HPGDCYP1A2CYP2C19BLM
SCHEMBL13989226 0.82 ALDH1A1 (0.34) ALDH1A1HPGDCYP1A2CYP2C19BLM
SCHEMBL5160607 0.81 ALDH1A1 (0.51) ALDH1A1HPGDCYP1A2CYP2C19BLM
SCHEMBL14984834 0.80 PTGS1 (0.49) ALDH1A1HPGDCYP1A2CYP2C19BLM
SCHEMBL7098923 0.80 GSK3A (0.50) ALDH1A1HPGDCYP1A2CYP2C19BLM
SCHEMBL5826261 0.79 MGLL (0.46) ALDH1A1HPGDCYP1A2CYP2C19BLM
SCHEMBL5166306 0.78 MAPK1 (0.58) ALDH1A1HPGDCYP1A2CYP2C19BLM

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9200104-B2 Polymer WARWICK EFFECT POLYMERS LIMITED (GB) 2015-12-01 US disclosed
US-9200104-B2 Polymer WARWICK EFFECT POLYMERS LIMITED (GB) 2015-12-01 US disclosed
US-20130295040-A1 POLYMER WARWICK EFFECT POLYMERS LTD (US) 2013-11-07 US disclosed
US-20130295040-A1 POLYMER WARWICK EFFECT POLYMERS LTD (US) 2013-11-07 US disclosed
US-8436104-B2 Polymer WARWICK EFFECT POLYMERS LIMITED (GB) 2013-05-07 US disclosed
US-8436104-B2 Polymer WARWICK EFFECT POLYMERS LIMITED (GB) 2013-05-07 US disclosed
EP-2161291-A2 Polymer Warwick Effect Polymers Limited (GB) 2010-03-10 EP disclosed
EP-1646661-B1 LIVING RADICAL POLYMERIZATION INITIATOR COMPRISING A FUNCTIONAL GROUP CAPABLE OF REACTING WITH POLYPEPTIDES OR THE LIKE, COMB POLYMER OBTAINED THEREWITH, POLYPEPTIDE CONJUGATES AND DRUNG OBTAINED THEREFROM WARWICK EFFECT POLYMERS LTD (GB) 2009-04-01 EP disclosed
US-20080300348-A1 Polymer WARWICK EFFECT POLYMERS LIMITED 2008-12-04 US disclosed
US-20080300348-A1 Polymer WARWICK EFFECT POLYMERS LIMITED 2008-12-04 US disclosed
US-20080300348-A1 Polymer WARWICK EFFECT POLYMERS LIMITED 2008-12-04 US disclosed
WO-2007104948-A2 POLYMERS WARWICK EFFECT POLYMERS LTD. (GB) 2007-09-20 WO disclosed
EP-1784430-A1 LIVING RADICAL POLYMERIZATION INITIATOR COMPRISING A FUNCTIONAL GROUP CAPABLE OF REACTING WITH POLYEPTIDES OR THE LIKE, COMB POLYMER OBTAINED THEREWITH , POLYPEPTIDE CONJUGATES AND DRUGS OBTAINED THEREFROM. Warwick Effect Polymers Limited (GB) 2007-05-16 EP disclosed
WO-2006003352-A1 LIVING RADICAL POLYMERIZATION INITIATOR COMPRISING A FUNCTIONAL GROUP CAPABLE OF REACTING WITH POLYEPTIDES OR THE LIKE, COMB POLYMER OBTAINED THEREWITH, POLYPEPTIDE CONJUGATES AND DRUGS OBTAINED THEREFROM WARWICK EFFECT POLYMERS LIMITED (GB) 2006-01-12 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-20130295040-A1 POLYMER PCNA, PARG, COASY ALDH1A1 4069/4885HPGD 3399/4885CYP1A2 3249/4885

“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.