SCHEMBL1479996

SCHEMBL1479996

CC(C)(C)c1cc(O)ccc1S(N)(=O)=O

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.59
ALOX15 P16050 2/20 0.59
LMNA P02545 2/20 0.59
HSD17B10 Q99714 2/20 0.59
NR1I2 O75469 1/20 0.59
CYP2C9 P11712 1/20 0.59
MIF P14174 1/20 0.59
TYR P14679 1/20 0.59
HTT P42858 1/20 0.59
NFE2L2 Q16236 1/20 0.59
CA2 P00918 9/20 0.42
CA12 O43570 2/20 0.42
CA1 P00915 2/20 0.42
CA9 Q16790 2/20 0.42
KDM4E B2RXH2 1/20 0.41
CYP1A2 P05177 1/20 0.41
MAPT P10636 1/20 0.41
ATP2A2 P16615 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
ATP2A3 Q93084 1/20 0.41

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
SCHEMBL11047523 0.84 ALDH1A1 (0.57) ALDH1A1ALOX15LMNAHSD17B10NR1I2
SCHEMBL7956212 0.83 ALDH1A1 (0.52) ALDH1A1ALOX15LMNAHSD17B10NR1I2
SCHEMBL2408402 0.78 L3MBTL1 (0.46) ALDH1A1CYP2C9CA2CA12CA1
SCHEMBL10906258 0.78 CA1 (0.49) ALDH1A1ALOX15HSD17B10NR1I2CA2
SCHEMBL8169096 0.78 ALDH1A1 (0.45) ALDH1A1LMNATYRCA2CA12
SCHEMBL1491209 0.77 CA2 (0.50) ALDH1A1CA2CA12CA1CA9
SCHEMBL4781209 0.77 CA1 (0.42) ALDH1A1LMNACA2CA12CA1
SCHEMBL30925348 0.77 PTGES2 (0.45) CA2CA12CA1CA9PTGS1
SCHEMBL3736629 0.77 ENPP2 (0.39) ALDH1A1ALOX15LMNAHSD17B10NR1I2
SCHEMBL28194860 0.76 PDIA6 (0.51) ALDH1A1CA2CA12CA1CA9

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
EP-0799614-A1 REMEDY FOR ISCHEMIC DISEASES CHUGAI SEIYAKU KABUSHIKI KAISHA (JP) 1997-10-08 EP claimed
US-7915295-B2 Viricides; HIV antivirals effective against problematic drug escape mutants; N-[(1S,1aR,7bR)-4,7-difluoro-1,1a,2,7b-tetrahydrocyclopropa[c]chromen-1-yl]-N'-[5-(4-(sulfonamido)phenoxy)-2-pyridinyl]urea MEDIVIR AB (SE) 2011-03-29 US disclosed
EP-1701942-B1 NON-NUCLEOTIDE REVERSE TRANSCRIPTASE INHIBITORS MEDIVIR AB (SE) 2009-12-09 EP disclosed
US-20080070951-A1 Non-Nucleotide Reverse Transcriptase Inhibitors MEDIVIR AB (SE) 2008-03-20 US disclosed
EP-1701942-A1 NON-NUCLEOTIDE REVERSE TRANSCRIPTASE INHIBITORS MEDIVIR AB (SE) 2006-09-20 EP disclosed
WO-2005066131-A1 NON-NUCLEOTIDE REVERSE TRANSCRIPTASE INHIBITORS MEDIVIR AB (SE) 2005-07-21 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-20080070951-A1 Non-Nucleotide Reverse Transcriptase Inhibitors RCOR1, RRM2, POLR1A ALDH1A1 2075/4885ALOX15 2593/4885LMNA 1547/4885

“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.