SCHEMBL7190604

SCHEMBL7190604

COc1cc(C=CC(=O)c2cccc(OC)c2OC)c(OC)c(OC)c1

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 2/20 0.55
PDE4A P27815 1/20 0.55
PDE4B Q07343 1/20 0.55
PDE4C Q08493 1/20 0.55
PDE4D Q08499 1/20 0.55
NFE2L2 Q16236 2/20 0.55
CYP3A4 P08684 1/20 0.55
MAPT P10636 3/20 0.53
CYP1A1 P04798 1/20 0.52
CYP1A2 P05177 1/20 0.52
CYP2D6 P10635 1/20 0.52
ALDH1A1 P00352 2/20 0.50
LMNA P02545 2/20 0.50
MAOB P27338 1/20 0.50
SMN1; SMN2 Q16637 1/20 0.50
ABCG2 Q9UNQ0 1/20 0.50
NR1H4 Q96RI1 1/20 0.50
KDM4E B2RXH2 1/20 0.50
MEN1 O00255 1/20 0.50
POLB P06746 1/20 0.50

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
SCHEMBL7190596 1.00 ALOX5 (0.55) ALOX5PDE4APDE4BPDE4CPDE4D
SCHEMBL7191889 0.91 PDE4A (0.60) ALOX5PDE4APDE4BPDE4CPDE4D
SCHEMBL7191886 0.91 PDE4A (0.60) ALOX5PDE4APDE4BPDE4CPDE4D
SCHEMBL7194479 0.88 PDE4A (0.58) PDE4APDE4BPDE4CPDE4DMAPT
SCHEMBL7194483 0.88 PDE4A (0.58) PDE4APDE4BPDE4CPDE4DMAPT
SCHEMBL7188173 0.87 PDE4A (0.70) PDE4APDE4BPDE4CPDE4DCYP3A4
SCHEMBL7188164 0.87 PDE4A (0.70) PDE4APDE4BPDE4CPDE4DCYP3A4
SCHEMBL4864045 0.86 NFE2L2 (0.72) ALOX5NFE2L2MAPTCYP1A1CYP1A2
SCHEMBL633510 0.86 MAPT (0.69) PDE4APDE4BPDE4CPDE4DMAPT
SCHEMBL633509 0.86 MAPT (0.69) PDE4APDE4BPDE4CPDE4DMAPT

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-20030065039-A1 Biologically active 1,3-bis-aromatic-prop-2-en-1-ones, 1,3-bis-aromatic-propan-1-ones, and 1,3-bis-aromatic-prop-2-yn-1-ones STATENS SERUM INSTITUTE (DK) 2003-04-03 US claimed

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-20030065039-A1 Biologically active 1,3-bis-aromatic-prop-2-en-1-ones, 1,3-bis-aromatic-propan-1-ones, and 1,3-bis-aromatic-prop-2-yn-1-ones AKR1C3, AKR1C1, AKR1A1 ALOX5 1298/4885PDE4A 3419/4885PDE4B 3413/4885

“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.