SCHEMBL7543725

SCHEMBL7543725

O=Cc1cc(O)ccc1Oc1ccc(O)cc1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 2/20 0.47
LMNA P02545 2/20 0.47
GAA P10253 1/20 0.47
MEN1 O00255 1/20 0.46
ESR1 P03372 1/20 0.46
ESR2 Q92731 1/20 0.46
ALDH1A1 P00352 1/20 0.46
CYP1A2 P05177 1/20 0.46
CYP2C9 P11712 1/20 0.46
CYP2C19 P33261 1/20 0.46
TRIM24 O15164 1/20 0.44
TYR P14679 1/20 0.44
TRIM33 Q9UPN9 1/20 0.44
ERN1 O75460 3/20 0.41
NPSR1 Q6W5P4 1/20 0.41
LTA4H P09960 2/20 0.41
NR1H2 P55055 1/20 0.41
BAX Q07812 1/20 0.41
TAAR5 O14804 1/20 0.40
TAAR1 Q96RJ0 1/20 0.40

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
SCHEMBL7185426 0.87 TTR (0.49) KMT2ALMNAGAAALDH1A1TYR
SCHEMBL16232845 0.87 ERN1 (0.53) KMT2ALMNAGAAMEN1ESR1
SCHEMBL16232872 0.84 NPSR1 (0.42) KMT2ALMNAGAAMEN1ALDH1A1
SCHEMBL27048589 0.81 ESR1 (0.46) KMT2ALMNAGAAMEN1ESR1
SCHEMBL29953580 0.77 BACE1 (0.60) ALDH1A1TRIM24TYRTRIM33ERN1
SCHEMBL1647101 0.77 BACE1 (0.60) ALDH1A1TRIM24TYRTRIM33ERN1
SCHEMBL19524136 0.76 LMNA (0.46) KMT2ALMNAGAAESR1ALDH1A1
SCHEMBL10331751 0.76 TYR (0.65) KMT2AMEN1ESR1ESR2TRIM24
SCHEMBL3887594 0.74 ERN1 (0.62) KMT2AMEN1ESR1ESR2TRIM24
SCHEMBL274702 0.74 LMNA (0.52) KMT2ALMNAGAAALDH1A1CYP1A2

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 KMT2A 3439/4885LMNA 4522/4885GAA 4156/4885

“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.