SCHEMBL22553049

SCHEMBL22553049

O=C(O)c1ccc(/C=C/c2ccccc2F)cc1

nearest known ligand 0.67

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
NFE2L2 Q16236 9/20 0.67
RELA Q04206 1/20 0.54
SNCA P37840 1/20 0.49
MAPT P10636 1/20 0.48
RECQL P46063 1/20 0.48
HDAC1 Q13547 1/20 0.47
TTR P02766 1/20 0.47
MAOB P27338 1/20 0.47
SLC16A3 O15427 1/20 0.46
ALDH1A1 P00352 1/20 0.46
FBP1 P09467 1/20 0.45

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
SCHEMBL22553051 1.00 NFE2L2 (0.67) NFE2L2RELASNCAMAPTRECQL
SCHEMBL10459190 0.87 HDAC1 (0.55) SNCAHDAC1TTRSLC16A3ALDH1A1
SCHEMBL10459191 0.87 HDAC1 (0.55) SNCAHDAC1TTRSLC16A3ALDH1A1
SCHEMBL22553033 0.81 NFE2L2 (0.55) NFE2L2HDAC1TTR
SCHEMBL7552105 0.81 ALDH1A1 (0.63) NFE2L2TTRALDH1A1
SCHEMBL3292441 0.81 NFE2L2 (1.00) NFE2L2RELA
SCHEMBL3292445 0.81 NFE2L2 (1.00) NFE2L2RELA
SCHEMBL11545296 0.81 HDAC1 (0.67) MAPTRECQLHDAC1TTRMAOB
SCHEMBL1927729 0.81 HDAC1 (0.67) MAPTRECQLHDAC1TTRMAOB
SCHEMBL14401252 0.81 NFE2L2 (1.00) NFE2L2RELA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10961178-B2 Cycloaddition reactions using quantum dots NORTHWESTERN UNIVERSITY (US) 2021-03-30 US disclosed
US-10961178-B2 Cycloaddition reactions using quantum dots NORTHWESTERN UNIVERSITY (US) 2021-03-30 US disclosed
US-20200331836-A1 CYCLOADDITION REACTIONS USING QUANTUM DOTS NORTHWESTERN UNIVERSITY 2020-10-22 US disclosed
US-20200331836-A1 CYCLOADDITION REACTIONS USING QUANTUM DOTS NORTHWESTERN UNIVERSITY 2020-10-22 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-20200331836-A1 CYCLOADDITION REACTIONS USING QUANTUM DOTS SYNGR2, SYNJ1, SQLE NFE2L2 882/4885RELA 1610/4885SNCA 16/4885
US-10961178-B2 Cycloaddition reactions using quantum dots SYNGR2, SYNJ1, SQLE NFE2L2 882/4885RELA 1610/4885SNCA 16/4885

“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.