SCHEMBL23901567

SCHEMBL23901567

CNC(Cc1ccc(OCc2ccccc2)cc1)C(=O)OCc1ccccc1

nearest known ligand 0.61

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
LTA4H P09960 2/20 0.61
LAP3 P28838 1/20 0.61
MMP9 P14780 1/20 0.60
MMP8 P22894 1/20 0.60
PPARG P37231 9/20 0.58
MME P08473 1/20 0.55
ACE P12821 1/20 0.55
CPA1 P15085 1/20 0.55
ACE2 Q9BYF1 1/20 0.55
PPARA Q07869 3/20 0.54
GPR34 Q9UPC5 1/20 0.54
FFAR1 O14842 1/20 0.54
FFAR4 Q5NUL3 1/20 0.54
MAOB P27338 2/20 0.53
PPARD Q03181 1/20 0.52

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
SCHEMBL16116809 0.92 GAA (0.58) LTA4HLAP3MMP9MMP8PPARG
SCHEMBL3499757 0.92 LTA4H (0.65) LTA4HLAP3MMP9MMP8PPARG
SCHEMBL3499760 0.92 LTA4H (0.65) LTA4HLAP3MMP9MMP8PPARG
Hydrochloric Acid SCHEMBL29693844 0.91 LTA4H (0.64) LTA4HLAP3MMP9MMP8PPARG
SCHEMBL13108402 0.90 TACR1 (0.58) ACE
SCHEMBL2059140 0.90 TACR1 (0.58) ACE
SCHEMBL12379283 0.90 LTA4H (0.62) LTA4HLAP3MMP9MMP8PPARG
SCHEMBL16063577 0.89 ATM (0.53) LTA4HPPARGPPARA
SCHEMBL2035189 0.89 PPARG (0.67) LTA4HMMP9MMP8PPARGMME
SCHEMBL8760872 0.89 PPARG (0.67) LTA4HMMP9MMP8PPARGMME

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230143470-A1 SMALL MOLECULE INHIBITORS OF INFLUENZA HEMAGGLUTININ NATIONAL INSTITUTES OF HEALTH 2023-05-11 US disclosed
WO-2021202600-A1 SMALL MOLECULE INHIBITORS OF INFLUENZA HEMAGGLUTININ THE SCRIPPS RESEARCH INSTITUTE (US) 2021-10-07 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-20230143470-A1 SMALL MOLECULE INHIBITORS OF INFLUENZA HEMAGGLUTININ HAVCR2, CD44, ENGASE LTA4H 488/4885LAP3 1122/4885MMP9 430/4885

“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.