SCHEMBL7196091

SCHEMBL7196091

O=C(O)c1ccc(S(=O)(=O)c2ccc(C(=O)O)c3ccccc23)cc1

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
APEX1 P27695 3/20 0.48
POLB P06746 2/20 0.48
KDM4E B2RXH2 2/20 0.48
CTDSP1 Q9GZU7 1/20 0.48
L3MBTL1 Q9Y468 1/20 0.48
MEN1 O00255 3/20 0.46
KMT2A Q03164 3/20 0.46
HSD17B10 Q99714 2/20 0.44
TSHR P16473 2/20 0.44
CA12 O43570 2/20 0.43
CA1 P00915 2/20 0.43
CA2 P00918 2/20 0.43
CA9 Q16790 2/20 0.43
CA14 Q9ULX7 2/20 0.43
CA3 P07451 1/20 0.43
CA6 P23280 1/20 0.43
CYP2C19 P33261 1/20 0.43
CA5A P35218 1/20 0.43
CA7 P43166 1/20 0.43
CA5B Q9Y2D0 1/20 0.43

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
SCHEMBL7545258 0.84 LDHA (0.53) POLBMEN1KMT2AHSD17B10TSHR
SCHEMBL7195905 0.84 HTR6 (0.40) HSD17B10FABP4HTR6CYP2C9MCL1
Terephthalic Acid SCHEMBL23387395 0.81 TSHR (0.59) APEX1POLBKDM4ECTDSP1L3MBTL1
SCHEMBL7195706 0.81 MEN1 (0.43) KDM4EMEN1KMT2AHSD17B10TSHR
SCHEMBL7191147 0.80 POLB (0.58) APEX1POLBKDM4ECTDSP1L3MBTL1
SCHEMBL7540102 0.79 HTR6 (0.64) POLBKMT2AHSD17B10TSHRCA12
SCHEMBL5059731 0.77 APEX1 (0.56) APEX1POLBKDM4ECTDSP1L3MBTL1
SCHEMBL29472291 0.76 CYP2D6 (0.50) KDM4EHSD17B10TSHRCA1CA2
SCHEMBL7190686 0.76 CYP2D6 (0.50) KDM4EHSD17B10TSHRCA1CA2
SCHEMBL10425701 0.76 HSD17B13 (0.51) APEX1POLBKDM4ECTDSP1L3MBTL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1304924-A2 COMPOSITIONS FOR REPELLING CRAWLING INSECTS Bayer Aktiengesellschaft (DE) 2003-05-02 EP disclosed
US-20020094993-A1 Compositions for repelling crawling insects S.C. JOHNSON & SON, INC. 2002-07-18 US disclosed
WO-2002005646-A2 COMPOSITIONS FOR REPELLING CRAWLING INSECTS S.C. JOHNSON & SON, INC. (US) (US) 2002-01-24 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-20020094993-A1 Compositions for repelling crawling insects ACHE, DDT, GAP43 APEX1 2491/4885POLB 3165/4885KDM4E 3406/4885

“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.