SCHEMBL5836682

SCHEMBL5836682

Oc1ccc(Oc2ccc(I)cc2)cc1

nearest known ligand 0.74

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.74
KMT2A Q03164 1/20 0.74
ESR1 P03372 1/20 0.74
ESR2 Q92731 1/20 0.74
LTA4H P09960 7/20 0.61
NR1H2 P55055 1/20 0.61
BAX Q07812 1/20 0.61
APP P05067 2/20 0.59
PARP10 Q53GL7 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
SCHEMBL3845620 0.86 LTA4H (0.50) MEN1KMT2AESR1ESR2LTA4H
SCHEMBL3841043 0.86 LTA4H (0.50) MEN1KMT2AESR1ESR2LTA4H
SCHEMBL2883028 0.86 LTA4H (0.50) MEN1KMT2AESR1ESR2LTA4H
SCHEMBL7811939 0.86 ESR2 (1.00) MEN1KMT2AESR1ESR2LTA4H
SCHEMBL3175106 0.86 ESR2 (1.00) MEN1KMT2AESR1ESR2LTA4H
SCHEMBL18198 0.86 ESR2 (1.00) MEN1KMT2AESR1ESR2LTA4H
SCHEMBL249169 0.86 ESR2 (1.00) MEN1KMT2AESR1ESR2LTA4H
SCHEMBL24414010 0.83 MEN1 (0.64) MEN1KMT2AESR1ESR2LTA4H
SCHEMBL24413544 0.83 MEN1 (0.50) MEN1KMT2AESR1ESR2LTA4H
Hydrogen Sulfide SCHEMBL27529439 0.83 MEN1 (0.93) MEN1KMT2AESR1ESR2LTA4H

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20220146930-A1 SALT, ACID GENERATOR, RESIST COMPOSITION AND METHOD FOR PRODUCING RESIST PATTERN SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2022-05-12 US disclosed
US-7119201-B2 Triaryl-oxy-aryloxy-pyrimidine-2,4,6-trione metalloproteinase inhibitors PFIZER INC (US) 2006-10-10 US disclosed
EP-1501515-B1 TRIARYL-OXY-ARYLOXY-PYRIMIDINE-2,4,6-TRIONE METALLOPROTEINASE INHIBITORS PFIZER PROD INC (US) 2005-11-02 EP disclosed
EP-1501515-A1 TRIARYL-OXY-ARYLOXY-PYRIMIDINE-2,4,6-TRIONE METALLOPROTEINASE INHIBITORS Pfizer Products Inc. (US) 2005-02-02 EP disclosed
US-20040006057-A1 Triaryl-oxy-aryloxy-pyrimidine-2,4,6-trione metalloproteinase inhibitors PFIZER PRODUCTS INC. 2004-01-08 US disclosed
WO-2003090752-A1 TRIARYL-OXY-ARYLOXY-PYRIMIDINE-2,4,6-TRIONE METALLOPROTEINASE INHIBITORS PFIZER PRODUCTS INC. (US) 2003-11-06 WO disclosed
US-4638099-A Method for making 4,4'-dihydroxydiphenyl ether ROHM GMBH (DE) 1987-01-20 US disclosed
US-4638099-A Method for making 4,4'-dihydroxydiphenyl ether ROHM GMBH (DE) 1987-01-20 US disclosed
US-4365991-A HERBICIDES HOFFMANN-LA ROCHE INC. (US) 1982-12-28 US 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 (2 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-20040006057-A1 Triaryl-oxy-aryloxy-pyrimidine-2,4,6-trione metalloproteinase inhibitors MMP8, MMP9, MMP1 MEN1 4607/4885KMT2A 2274/4885ESR1 1606/4885
US-20220146930-A1 SALT, ACID GENERATOR, RESIST COMPOSITION AND METHOD FOR PRODUCING RESIST PATTERN RER1, FGFR1, NHERF1 MEN1 2209/4885KMT2A 1914/4885ESR1 662/4885

“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.