SCHEMBL7187065

SCHEMBL7187065

CCCCCCOc1ccc(OCCCCCC)c(C=CC(=O)c2cccc(OCCCCCC)c2OCCCCCC)c1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYSLTR2 Q9NS75 2/20 0.51
PTPN11 Q06124 2/20 0.46
PDE4A P27815 1/20 0.46
PDE4B Q07343 1/20 0.46
PDE4C Q08493 1/20 0.46
PDE4D Q08499 1/20 0.46
MEN1 O00255 1/20 0.45
NR1I2 O75469 1/20 0.45
LMNA P02545 1/20 0.45
CHRM2 P08172 1/20 0.45
CYP3A4 P08684 1/20 0.45
ADRA2A P08913 1/20 0.45
MAPT P10636 1/20 0.45
OPRK1 P41145 1/20 0.45
HTR2B P41595 1/20 0.45
SLC6A3 Q01959 1/20 0.45
KMT2A Q03164 1/20 0.45
HDAC6 Q9UBN7 1/20 0.45
PTGES O14684 1/20 0.44
ALOX5 P09917 1/20 0.44

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
SCHEMBL7189044 0.99 CYSLTR2 (0.49) CYSLTR2PTPN11PDE4APDE4BPDE4C
SCHEMBL7188232 0.97 ALOX5 (0.47) CYSLTR2PDE4APDE4BPDE4CPDE4D
SCHEMBL7188236 0.97 ALOX5 (0.47) CYSLTR2PDE4APDE4BPDE4CPDE4D
SCHEMBL7194861 0.92 AR (0.51) CYSLTR2PDE4APDE4BPDE4CPDE4D
SCHEMBL7194870 0.92 AR (0.51) CYSLTR2PDE4APDE4BPDE4CPDE4D
SCHEMBL7190721 0.90 LMNA (0.54) CYSLTR2PTPN11PDE4APDE4BPDE4C
SCHEMBL7194150 0.89 LMNA (0.52) CYSLTR2PTPN11PDE4APDE4BPDE4C
SCHEMBL7194173 0.88 LMNA (0.44) CYSLTR2PTPN11MEN1NR1I2LMNA
SCHEMBL7191715 0.88 PDE4A (0.49) CYSLTR2PTPN11PDE4APDE4BPDE4C
SCHEMBL7194123 0.88 PDE4A (0.45) CYSLTR2PDE4APDE4BPDE4CPDE4D

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 CYSLTR2 1675/4885PTPN11 2391/4885PDE4A 3419/4885

“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.