SCHEMBL7196896

SCHEMBL7196896

O=S(=O)(c1ccc(O)cc1O)c1cccc2ccccc12

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALPL P05186 1/20 0.61
ALPI P09923 1/20 0.61
ALPG P10696 1/20 0.61
DNMT1 P26358 1/20 0.61
MCL1 Q07820 1/20 0.61
TDP1 Q9NUW8 1/20 0.61
L3MBTL1 Q9Y468 1/20 0.61
CA1 P00915 1/20 0.51
CA2 P00918 1/20 0.51
CA9 Q16790 1/20 0.51
HCRTR1 O43613 1/20 0.50
HSP90AA1 P07900 2/20 0.48
HSP90AB1 P08238 2/20 0.48
HTR6 P50406 3/20 0.47
ESR1 P03372 3/20 0.47
ESR2 Q92731 3/20 0.47
F2 P00734 1/20 0.44
PRSS1 P07477 1/20 0.44
PRSS2 P07478 1/20 0.44
PRSS3 P35030 1/20 0.44

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
SCHEMBL10610440 0.87 ALPL (0.81) ALPLALPIALPGDNMT1MCL1
SCHEMBL7190517 0.84 CA1 (0.60) ALPLALPIALPGDNMT1MCL1
SCHEMBL8509035 0.84 ALPL (0.54) ALPLALPIALPGDNMT1MCL1
SCHEMBL8509349 0.84 ALPL (0.54) ALPLALPIALPGDNMT1MCL1
SCHEMBL3518399 0.81 ALPL (0.61) ALPLALPIALPGDNMT1MCL1
SCHEMBL8508718 0.81 ALPL (0.50) ALPLALPIALPGDNMT1MCL1
SCHEMBL30678708 0.80 ALPL (0.52) ALPLALPIALPGDNMT1MCL1
SCHEMBL278795 0.80 ALPL (0.52) ALPLALPIALPGDNMT1MCL1
SCHEMBL547461 0.80 CA1 (0.68) ALPLALPIALPGDNMT1MCL1
SCHEMBL9456434 0.80 CA1 (0.55) ALPLALPIALPGDNMT1MCL1

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 ALPL 1713/4885ALPI 3594/4885ALPG 249/4885

“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.