SCHEMBL7183343

SCHEMBL7183343

Oc1ccc(OOc2ccccc2O)cc1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LTA4H P09960 2/20 0.46
CA2 P00918 2/20 0.46
CA1 P00915 1/20 0.46
TP53 P04637 1/20 0.46
TSHR P16473 1/20 0.46
NR1H2 P55055 1/20 0.46
BAX Q07812 1/20 0.46
LMNA P02545 3/20 0.43
MAPT P10636 2/20 0.43
GAA P10253 2/20 0.43
JAK2 O60674 1/20 0.43
ESR2 Q92731 3/20 0.42
ESR1 P03372 2/20 0.42
MEN1 O00255 1/20 0.42
KMT2A Q03164 1/20 0.42
CYP1A2 P05177 2/20 0.41
HIF1A Q16665 2/20 0.41
PTGS1 P23219 1/20 0.41
SLC6A2 P23975 1/20 0.41
CYP2C19 P33261 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
SCHEMBL7191128 0.86 CA2 (0.50) LTA4HCA2CA1TP53TSHR
SCHEMBL7177698 0.83 CA2 (0.62) CA2CA1TP53TSHRLMNA
SCHEMBL68185 0.80 LTA4H (0.60) LTA4HCA2CA1TP53TSHR
Mequinol SCHEMBL3822554 0.79 CA1 (0.72) LTA4HCA2CA1TP53TSHR
SCHEMBL7191723 0.79 CA1 (0.50) CA2CA1TP53TSHRESR2
SCHEMBL27735401 0.79 LTA4H (0.71) LTA4HCA2CA1TSHRNR1H2
SCHEMBL1191086 0.78 ESR2 (0.65) LTA4HCA2CA1NR1H2BAX
SCHEMBL7202257 0.75 ALOX5 (0.45) LTA4HNR1H2BAXGAAESR2
SCHEMBL7537862 0.75 ALDH1A1 (0.53) LTA4HNR1H2BAXLMNAMAPT
SCHEMBL2834163 0.74 CA2 (0.56) CA2CA1TP53TSHRLMNA

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 LTA4H 1285/4885CA2 1428/4885CA1 1889/4885

“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.