SCHEMBL824080

SCHEMBL824080

C=CCCCC[Si](C)(O[Si](C)(C)C)O[Si](C)(C)C

nearest known ligand 0.39

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.39
ALDH1A1 P00352 2/20 0.37
LMNA P02545 1/20 0.34
LPAR3 Q9UBY5 2/20 0.31
LPAR2 Q9HBW0 1/20 0.31
ABCC4 O15439 1/20 0.30
MAPT P10636 1/20 0.30

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
SCHEMBL1242601 0.83 TSHR (0.39) TSHRALDH1A1LMNALPAR3LPAR2
SCHEMBL247533 0.83 TSHR (0.39) TSHRALDH1A1LMNALPAR3LPAR2
SCHEMBL23499896 0.83 TSHR (0.39) TSHRALDH1A1LMNALPAR3LPAR2
SCHEMBL1398289 0.81 TSHR (0.43) TSHRALDH1A1LMNALPAR3LPAR2
SCHEMBL1241846 0.81 TSHR (0.43) TSHRALDH1A1LMNALPAR3LPAR2
SCHEMBL1243010 0.81 TSHR (0.43) TSHRALDH1A1LMNALPAR3LPAR2
SCHEMBL1398303 0.81 TSHR (0.43) TSHRALDH1A1LMNALPAR3LPAR2
SCHEMBL1241876 0.81 TSHR (0.43) TSHRALDH1A1LMNALPAR3LPAR2
SCHEMBL1241819 0.81 TSHR (0.43) TSHRALDH1A1LMNALPAR3LPAR2
SCHEMBL26193033 0.81 TSHR (0.43) TSHRALDH1A1LMNALPAR3LPAR2

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-8143362-B2 Composition containing unsaturated silicone compounds, dental materials containing them and use thereof 3M INNOVATIVE PROPERTIES COMPANY (US) 2012-03-27 US disclosed
US-20100331444-A1 COMPOSITION CONTAINING UNSATURATED SILICONE COMPOUNDS, DENTAL MATERIALS CONTAINING THEM AND USE THEREOF 3M ESPE AG (A WHOLLY-OWNED SUBSIDUARY OF 3M COMPANY) 2010-12-30 US disclosed
US-7807730-B2 Composition containing unsaturated silicone compounds, dental materials containing them and use thereof 3M ESPE AG (DE) 2010-10-05 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 (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-20100331444-A1 COMPOSITION CONTAINING UNSATURATED SILICONE COMPOUNDS, DENTAL MATERIALS CONTAINING THEM AND USE THEREOF SMCHD1, CAD, ESD TSHR 3257/4885ALDH1A1 1550/4885LMNA 664/4885

“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.