SCHEMBL7542969

SCHEMBL7542969

O=Cc1ccccc1OOc1ccc(C(=O)O)cc1O

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TTR P02766 2/20 0.55
PTGDR2 Q9Y5Y4 1/20 0.45
ERN1 O75460 4/20 0.44
GAA P10253 4/20 0.43
POLB P06746 2/20 0.43
MAPT P10636 2/20 0.43
L3MBTL1 Q9Y468 2/20 0.43
KDM4E B2RXH2 2/20 0.43
CA12 O43570 1/20 0.43
CA1 P00915 1/20 0.43
CA2 P00918 1/20 0.43
CA4 P22748 1/20 0.43
CA6 P23280 1/20 0.43
PTGS2 P35354 1/20 0.43
CA7 P43166 1/20 0.43
CA9 Q16790 1/20 0.43
CA14 Q9ULX7 1/20 0.43
KMT2A Q03164 3/20 0.42
LMNA P02545 1/20 0.42
KDM5A P29375 1/20 0.42

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
SCHEMBL7536365 0.88 TTR (0.63) TTRPTGDR2ERN1GAAPOLB
SCHEMBL7190620 0.80 LMNA (0.50) PTGDR2ERN1GAACA1CA2
SCHEMBL7191617 0.80 TTR (0.73) TTRGAAPOLBMAPTL3MBTL1
SCHEMBL7542886 0.79 TTR (0.50) TTRERN1GAAPOLBMAPT
SCHEMBL7191092 0.77 TTR (0.55) TTRGAAPOLBMAPTL3MBTL1
SCHEMBL7201515 0.76 MRGPRX4 (0.50) GAAPOLBMAPTL3MBTL1KDM4E
SCHEMBL2558291 0.75 TTR (0.50) TTRERN1GAAPOLBMAPT
SCHEMBL850871 0.73 MAPT (0.59) TTRERN1GAAPOLBMAPT
SCHEMBL28067566 0.73 TTR (0.57) TTRERN1GAAPOLBMAPT
SCHEMBL3129398 0.72 LMNA (0.65) TTRPTGDR2ERN1GAAKDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20020094993-A1 Compositions for repelling crawling insects S.C. JOHNSON & SON, INC. 2002-07-18 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 (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 2691/4885PTGDR2 4258/4885ERN1 4751/4885

“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.