SCHEMBL4950820

SCHEMBL4950820

C=CCC.C=CCC.C=CCC.C=CCC.C=CCC

nearest known ligand 0.50

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
TSHR P16473 6/20 0.50
ALDH1A1 P00352 5/20 0.44
MAPK1 P28482 1/20 0.39
TDP1 Q9NUW8 1/20 0.39
TRPA1 O75762 1/20 0.33
CYP3A4 P08684 1/20 0.33
HPGD P15428 1/20 0.33
ALOX15 P16050 1/20 0.33
ALOX5 P09917 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33

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
SCHEMBL3814841 1.00
SCHEMBL5606390 1.00
SCHEMBL4901795 1.00 TSHR (0.50) TSHRALDH1A1MAPK1TDP1TRPA1
SCHEMBL10862 1.00
SCHEMBL2430668 1.00 TSHR (0.50) TSHRALDH1A1MAPK1TDP1TRPA1
Hydrogen Sulfide SCHEMBL6569480 0.95
SCHEMBL7943710 0.95
Ethylene SCHEMBL76814 0.95
SCHEMBL11303058 0.95
Iodide SCHEMBL8019411 0.95

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-7317130-B2 Method for the hydroformylation of olefinically unsaturated compounds, especially olefins, in the presence of cyclic carbonic acid esters OXENO OLEFINCHEMIE GMBH (DE) 2008-01-08 US disclosed
US-20060241324-A1 Method for the hydroformylation of olefinically unsaturated compounds, especially olefins,in the presence of cyclic carbonic acid esters OXENO OLEFINCHEMIE GMBH (DE) 2006-10-26 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-20060241324-A1 Method for the hydroformylation of olefinically unsaturated compounds, especially olefins,in the presence of cyclic carbonic acid esters ELOVL6, ELOVL1, ELOVL5 TSHR 3682/4885ALDH1A1 173/4885MAPK1 3944/4885

“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.