SCHEMBL12994166

SCHEMBL12994166

CC(C)(O)C(=O)c1ccc(OCCOC(=O)CCBr)cc1

nearest known ligand 0.43

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
MAPT P10636 4/20 0.43
L3MBTL1 Q9Y468 5/20 0.41
HTT P42858 1/20 0.40
PKM P14618 1/20 0.40
GAA P10253 1/20 0.40
POLB P06746 1/20 0.39
RAB9A P51151 1/20 0.39
ALDH1A1 P00352 1/20 0.38
RECQL P46063 1/20 0.38
PARP10 Q53GL7 1/20 0.38
LMNA P02545 1/20 0.38
PPARA Q07869 1/20 0.37
THRA P10827 1/20 0.36
TDP1 Q9NUW8 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
SCHEMBL22304761 0.89 MAPT (0.45) MAPTL3MBTL1HTTPKMGAA
SCHEMBL12994174 0.87 L3MBTL1 (0.47) MAPTL3MBTL1HTTPOLBLMNA
SCHEMBL3680765 0.86 MAPT (0.43) MAPTL3MBTL1HTTPKMGAA
SCHEMBL3372714 0.86 MAPT (0.46) MAPTL3MBTL1HTTPOLBRAB9A
SCHEMBL2384863 0.86 L3MBTL1 (0.45) MAPTL3MBTL1HTTPKMGAA
SCHEMBL12328386 0.86 MAPT (0.43) MAPTL3MBTL1HTTPKMGAA
SCHEMBL3975588 0.85 L3MBTL1 (0.47) MAPTL3MBTL1PKMGAARAB9A
SCHEMBL24141546 0.85 MAPT (0.42) MAPTL3MBTL1HTTPKMGAA
SCHEMBL12994172 0.85 PKM (0.53) MAPTL3MBTL1PKMPOLBRAB9A
SCHEMBL12799434 0.84 HTT (0.56) MAPTL3MBTL1HTTPKMGAA

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 7 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-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-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-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

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 MAPT 4314/4885L3MBTL1 935/4885HTT 1277/4885
US-20140024840-A1 PREPARATION METHOD OF COPOLYMERIZABLE PHOTOINITIATORS HBB, HBZ, HBG1 MAPT 4435/4885L3MBTL1 1025/4885HTT 1192/4885

“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.