SCHEMBL7189933

SCHEMBL7189933

O=Cc1c(S(=O)(=O)O)ccc(S(=O)(=O)O)c1S(=O)(=O)O

nearest known ligand 0.32

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TTR P02766 1/20 0.32
TSHR P16473 2/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
LMNA P02545 2/20 0.32
HIF1A Q16665 2/20 0.32
HSD17B10 Q99714 2/20 0.32
HPGD P15428 1/20 0.32
COMT P21964 1/20 0.32
PGAM1 P18669 1/20 0.32
AURKA O14965 1/20 0.32
AURKB Q96GD4 1/20 0.32
TDP1 Q9NUW8 2/20 0.31
PADI4 Q9UM07 1/20 0.31
ALDH1A1 P00352 3/20 0.31
MEN1 O00255 1/20 0.31
KMT2A Q03164 1/20 0.31
MYC P01106 1/20 0.31
RAD1 O60671 1/20 0.30
P2RY6 Q15077 1/20 0.30
CYP2D6 P10635 1/20 0.30

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
SCHEMBL8055324 0.89 RAD1 (0.34) LMNAHIF1AHSD17B10TDP1ALDH1A1
SCHEMBL10921837 0.79 TSHR (0.41) TTRTSHRSMN1; SMN2LMNAHIF1A
SCHEMBL3294201 0.78 TTR (0.47) TTRTSHRSMN1; SMN2LMNAHIF1A
SCHEMBL28375176 0.76 TTR (0.45) TTRTSHRSMN1; SMN2LMNAHIF1A
SCHEMBL17982110 0.76 TTR (0.45) TTRTSHRSMN1; SMN2LMNAHSD17B10
SCHEMBL224921 0.73 TDP1 (0.44) TTRTSHRSMN1; SMN2LMNATDP1
SCHEMBL7197507 0.72 TTR (0.46) TTRHIF1AHSD17B10COMTAURKA
SCHEMBL129104 0.71 ERN1 (0.59) TSHRSMN1; SMN2HIF1AHSD17B10TDP1
SCHEMBL11352006 0.71 TTR (0.55) TTRHIF1AHSD17B10COMTAURKA
SCHEMBL28565466 0.71 TDP1 (0.42) TTRTSHRLMNATDP1ALDH1A1

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 TTR 2691/4885TSHR 4831/4885SMN1; SMN2 2971/4885

“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.