SCHEMBL6753149

SCHEMBL6753149

C=CC(=O)OC(COc1ccc(Cc2ccc(OCC(CSc3ccccc3)OC(=O)C=C)cc2)cc1)CSc1ccccc1

nearest known ligand 0.50

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
BACE1 P56817 2/20 0.50
THRB P10828 1/20 0.39
MMP3 P08254 1/20 0.39
EGFR P00533 1/20 0.38
PPARD Q03181 2/20 0.37
PPARG P37231 4/20 0.36
PPARA Q07869 4/20 0.36
MEN1 O00255 1/20 0.36
KMT2A Q03164 1/20 0.36
PLA2G2A P14555 2/20 0.35
LMNA P02545 1/20 0.35
MAPK1 P28482 1/20 0.35
CASP3 P42574 1/20 0.35
SENP7 Q9BQF6 1/20 0.35
SENP6 Q9GZR1 1/20 0.35
L3MBTL1 Q9Y468 1/20 0.35
SRD5A2 P31213 1/20 0.35
LTA4H P09960 1/20 0.34

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
SCHEMBL4759193 0.92 THRB (0.47) BACE1THRBMMP3EGFRPPARD
SCHEMBL6751654 0.91 BACE1 (0.42) BACE1THRBMMP3EGFRPPARD
SCHEMBL6753001 0.91 MMP3 (0.47) BACE1THRBMMP3EGFRPPARD
SCHEMBL4759204 0.88 PPARG (0.44) BACE1THRBMMP3PPARGPPARA
SCHEMBL19944471 0.86 THRB (0.46) BACE1THRBPPARGPPARALMNA
SCHEMBL6752943 0.86 THRB (0.41) THRBMMP3PPARDMEN1KMT2A
SCHEMBL4198635 0.86 THRB (0.47) BACE1THRBMMP3PPARDPPARA
SCHEMBL6753008 0.85 AR (0.43) PPARDPPARAMEN1KMT2A
SCHEMBL6749668 0.85 PTPN7 (0.40) BACE1THRBMMP3PPARDPPARG
SCHEMBL5092633 0.82 MTNR1A (0.43) THRBMMP3PPARGPPARAMAPK1

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-20040039080-A1 Dental material and composition SUN MEDICAL CO., LTD. (JP) 2004-02-26 US disclosed
EP-1334711-A1 DENTAL MATERIAL AND COMPOSITION SUN MEDICAL CO., LTD. (JP) 2003-08-13 EP 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-20040039080-A1 Dental material and composition RPS12, RPS21, RPS14 BACE1 4744/4885THRB 2370/4885MMP3 4252/4885

“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.