SCHEMBL3677849

SCHEMBL3677849

CC(O)(Cc1ccc(OCCOC(=O)CCBr)cc1)C(=O)C(C)(O)Cc1ccc(OCCOC(=O)CCBr)cc1

nearest known ligand 0.40

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.40
L3MBTL1 Q9Y468 1/20 0.40
ALDH1A1 P00352 1/20 0.39
ACACB O00763 2/20 0.38
PPARG P37231 2/20 0.37
PPARD Q03181 2/20 0.37
PPARA Q07869 2/20 0.37
RECQL P46063 1/20 0.37
FFAR1 O14842 2/20 0.37
LTA4H P09960 2/20 0.36
S1PR4 O95977 1/20 0.36
S1PR1 P21453 1/20 0.36
S1PR3 Q99500 1/20 0.36
MMP1 P03956 1/20 0.36
MMP9 P14780 1/20 0.36
MMP13 P45452 1/20 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
SCHEMBL3680771 0.87 PPARD (0.40) LMNAL3MBTL1ALDH1A1ACACBPPARG
SCHEMBL196997 0.79 THRB (0.57) LMNAL3MBTL1ALDH1A1ACACBPPARG
SCHEMBL6562700 0.79 POLB (0.50) LMNAL3MBTL1ALDH1A1ACACBPPARG
SCHEMBL127434 0.79 CYP3A4 (0.47) LMNAL3MBTL1ALDH1A1ACACBPPARG
SCHEMBL12994166 0.78 MAPT (0.43) LMNAL3MBTL1ALDH1A1PPARARECQL
SCHEMBL7650076 0.77 LTA4H (0.46) LMNAALDH1A1ACACBPPARGPPARD
SCHEMBL5560855 0.76 PPARA (0.41) LMNAALDH1A1ACACBPPARA
SCHEMBL8385819 0.75 ALDH1A1 (0.39) LMNAL3MBTL1ALDH1A1ACACBPPARG
SCHEMBL10528978 0.74 THRB (0.56) ALDH1A1RECQLFFAR1MMP1
SCHEMBL7764968 0.73 CYP3A4 (0.45) LMNAL3MBTL1ALDH1A1ACACBPPARG

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-8791289-B2 Preparation method of copolymerizable photoinitiators AGFA GRAPHICS NV (BE) 2014-07-29 US disclosed
US-8664431-B2 Preparation method of copolymerizable photoinitiators AGFA GRAPHICS NV (BE) 2014-03-04 US disclosed
US-20140024840-A1 PREPARATION METHOD OF COPOLYMERIZABLE PHOTOINITIATORS AGFA GRAPHICS NV (BE) 2014-01-23 US disclosed
US-20100305336-A1 PREPARATION METHOD OF COPOLYMERIZABLE PHOTOINITIATORS AGFA GRAPHICS NV (BE) 2010-12-02 US disclosed
WO-2009068590-A1 PREPARATION METHOD OF COPOLYMERIZABLE PHOTOINITIATORS AGFA GRAPHICS NV (BE) 2009-06-04 WO disclosed
EP-2065362-A1 Preparation method of copolymerizable photoinitiators Agfa Graphics N.V. (BE) 2009-06-03 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 (2 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-20100305336-A1 PREPARATION METHOD OF COPOLYMERIZABLE PHOTOINITIATORS HBB, HBZ, HBG1 LMNA 412/4885L3MBTL1 935/4885ALDH1A1 390/4885
US-20140024840-A1 PREPARATION METHOD OF COPOLYMERIZABLE PHOTOINITIATORS HBB, HBZ, HBG1 LMNA 408/4885L3MBTL1 1025/4885ALDH1A1 371/4885

“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.