SCHEMBL8577993

SCHEMBL8577993

CC[Si](C)(O)Cc1ccccc1

nearest known ligand 0.44

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
TP53 P04637 1/20 0.44
NR1H2 P55055 2/20 0.40
NR1H3 Q13133 2/20 0.40
TSHR P16473 2/20 0.39
TRPA1 O75762 2/20 0.38
ESR1 P03372 1/20 0.37
CALM1 P0DP23 1/20 0.36
TDP1 Q9NUW8 1/20 0.36
ALDH1A1 P00352 2/20 0.34
IDO1 P14902 2/20 0.34
THRB P10828 1/20 0.34
CES2 O00748 1/20 0.34
CES1 P23141 1/20 0.34
AKR1B1 P15121 1/20 0.34
LMNA P02545 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
SCHEMBL28136682 0.88 TSHR (0.43) TP53NR1H2NR1H3TSHRTRPA1
SCHEMBL8616446 0.81 TP53 (0.48) TP53NR1H2NR1H3TSHRTRPA1
SCHEMBL15302665 0.79 TP53 (0.46) TP53NR1H2NR1H3TSHRTRPA1
SCHEMBL3503476 0.79 TP53 (0.46) TP53NR1H2NR1H3TSHRTRPA1
SCHEMBL4514772 0.78 TSHR (0.43) TP53NR1H2NR1H3TSHRTRPA1
SCHEMBL679387 0.78 TSHR (0.43) TP53NR1H2NR1H3TSHRTRPA1
SCHEMBL16378246 0.78 TP53 (0.48) TP53NR1H2NR1H3TSHRTRPA1
SCHEMBL14838179 0.76 TP53 (0.48) TP53NR1H2NR1H3TSHRTRPA1
SCHEMBL2286891 0.75 NR1H2 (0.39) TP53NR1H2NR1H3TSHRTRPA1
SCHEMBL11740122 0.74 TP53 (0.46) TP53NR1H2NR1H3TSHRTRPA1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090203644-A1 Compositions for treating and/or preventing diseases characterized by the presence of metal ions GRENPHARMA LLC (US) 2009-08-13 US disclosed
US-5808112-A Preparation of cis-4-O-protected-2-cyclopentenol derivatives HOECHST MARION ROUSSEL INC. (US) 1998-09-15 US disclosed
CN-1179770-A Preparation of cis- 4 -0 -protected -2 -cyclopentenol derivatives HOECHST MARION ROUSSEL INC (US) 1998-04-22 CN disclosed
US-5728899-A Preparation of cis-4-O-protected-2-cyclopentenol derivatives HOECHST MARION ROUSSEL INC. (US) 1998-03-17 US disclosed
EP-0817764-A1 PREPARATION OF CIS-4-O-PROTECTED-2-CYCLOPENTENOL DERIVATIVES HOECHST MARION ROUSSEL, INC. (US) 1998-01-14 EP disclosed
WO-1996030320-A1 PREPARATION OF CIS-4-O-PROTECTED-2-CYCLOPENTENOL DERIVATIVES HOECHST MARION ROUSSEL, INC. (US) 1996-10-03 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-20090203644-A1 Compositions for treating and/or preventing diseases characterized by the presence of metal ions APP, PSEN1, IAPP TP53 241/4885NR1H2 4304/4885NR1H3 4053/4885

“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.