SCHEMBL6154322

SCHEMBL6154322

Oc1ccc(Oc2c[c]ccc2)cc1

nearest known ligand 0.59

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
LTA4H P09960 8/20 0.59
NR1H2 P55055 1/20 0.59
BAX Q07812 1/20 0.59
MEN1 O00255 2/20 0.56
KMT2A Q03164 2/20 0.56
ESR1 P03372 1/20 0.56
ESR2 Q92731 1/20 0.56
PARP10 Q53GL7 1/20 0.41
TSHR P16473 1/20 0.37
ALDH1A1 P00352 1/20 0.36
LMNA P02545 1/20 0.36
HPGD P15428 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
CA1 P00915 1/20 0.35
CA2 P00918 1/20 0.35

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
SCHEMBL28072263 0.85 LTA4H (0.55) LTA4HNR1H2BAXMEN1KMT2A
SCHEMBL8155454 0.85 LTA4H (0.43) LTA4HNR1H2BAXMEN1KMT2A
SCHEMBL61732 0.83 LTA4H (0.57) LTA4HNR1H2BAXMEN1KMT2A
SCHEMBL9450784 0.81 LTA4H (0.42) LTA4HNR1H2BAXMEN1KMT2A
SCHEMBL6154747 0.81 CYP3A4 (0.42) LTA4HNR1H2BAXESR1ESR2
SCHEMBL920289 0.80 TEAD4 (0.47) LTA4HNR1H2BAXMEN1KMT2A
SCHEMBL919392 0.80 LTA4H (0.59) LTA4HMEN1KMT2APARP10TSHR
SCHEMBL157734 0.80 SOS1 (0.40) LTA4HNR1H2BAXMEN1KMT2A
SCHEMBL511009 0.80 MAOA (0.47) LTA4HMEN1KMT2ATSHRALDH1A1
SCHEMBL4909322 0.80 MAPT (0.47) LTA4HNR1H2BAXMEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20050065118-A1 Organosulfur inhibitors of tyrosine phosphatases METABASIS THERAPEUTICS, INC. 2005-03-24 US disclosed
EP-1446110-A2 ORGANOSULFUR INHIBITORS OF TYROSINE PHOSPHATASES Structural Bioinformatics Inc. (US) 2004-08-18 EP disclosed
WO-2003032916-A2 ORGANOSULFUR INHIBITORS OF TYROSINE PHOSPHATASES STRUCTURAL BIOINFORMATICS INC. (US) 2003-04-24 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-20050065118-A1 Organosulfur inhibitors of tyrosine phosphatases PTPRS, PTPRJ, PTPRCAP LTA4H 2659/4885NR1H2 4459/4885BAX 4138/4885

“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.