SCHEMBL7192562

SCHEMBL7192562

CCCCCCOc1cc(OCCCCCC)cc(C(=O)C=Cc2cc(CC)ccc2OCCCCCC)c1

nearest known ligand 0.50

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
PLA2G2A P14555 1/20 0.50
DPP4 P27487 3/20 0.47
PTPN1 P18031 1/20 0.47
ABCG2 Q9UNQ0 2/20 0.43
CYSLTR2 Q9NS75 1/20 0.43
ALDH1A1 P00352 1/20 0.43
HPGD P15428 1/20 0.43
BCHE P06276 2/20 0.42
ACHE P22303 1/20 0.42
LTB4R Q15722 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
SCHEMBL7193971 0.99 DPP4 (0.48) PLA2G2ADPP4PTPN1ABCG2CYSLTR2
SCHEMBL7188091 0.95 DPP4 (0.52) PLA2G2ADPP4PTPN1ABCG2BCHE
SCHEMBL7188102 0.95 DPP4 (0.52) PLA2G2ADPP4PTPN1ABCG2BCHE
SCHEMBL7193944 0.92 DPP4 (0.50) DPP4PTPN1ABCG2
SCHEMBL7193951 0.92 DPP4 (0.50) DPP4PTPN1ABCG2
SCHEMBL7198567 0.90 SMPD1 (0.52) DPP4PTPN1CYSLTR2LTB4R
SCHEMBL7193939 0.89 SMPD1 (0.50) DPP4PTPN1CYSLTR2LTB4R
SCHEMBL7188130 0.86 MAOB (0.53) DPP4PTPN1ABCG2ALDH1A1
SCHEMBL7188125 0.86 MAOB (0.53) DPP4PTPN1ABCG2ALDH1A1
SCHEMBL7196595 0.85 CYSLTR2 (0.52) DPP4PTPN1CYSLTR2

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 PLA2G2A 4240/4885DPP4 1733/4885PTPN1 872/4885

“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.