Decane

Decane

SCHEMBL2401068

C=C(C)C(=O)OCCOC(=O)C(=C)C.CCCCCCCCCC.CCCCCCCCCC.CCCCCCCCCC.CCCCCCCCCC.CCCCCCCCCC

nearest known ligand 0.88

Full drug profile on Sugi Atlas →

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
TSHR P16473 5/20 0.88
THRB P10828 2/20 0.64
DGKA P23743 1/20 0.52
NAAA Q02083 1/20 0.47
ALDH1A1 P00352 3/20 0.46
POLB P06746 1/20 0.46
APEX1 P27695 1/20 0.46
HTT P42858 1/20 0.46
TDP1 Q9NUW8 1/20 0.46
CES2 O00748 1/20 0.45
RAD52 P43351 1/20 0.44
NPSR1 Q6W5P4 1/20 0.44
EPHX1 P07099 1/20 0.44
THRA P10827 1/20 0.43
HPGD P15428 1/20 0.41
ACHE P22303 1/20 0.41

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
Decane SCHEMBL2401531 1.00 TSHR (0.88) TSHRTHRBDGKANAAAALDH1A1
Tridecane SCHEMBL2399921 1.00 TSHR (0.88) TSHRTHRBDGKANAAAALDH1A1
SCHEMBL1018256 1.00 TSHR (0.88) TSHRTHRBDGKANAAAALDH1A1
Dodecane SCHEMBL2402308 1.00 TSHR (0.88) TSHRTHRBDGKANAAAALDH1A1
SCHEMBL2401084 1.00 TSHR (0.88) TSHRTHRBDGKANAAAALDH1A1
Nonane SCHEMBL18816369 1.00 TSHR (0.88) TSHRTHRBDGKANAAAALDH1A1
Decane SCHEMBL2402324 1.00 TSHR (0.88) TSHRTHRBDGKANAAAALDH1A1
Decane SCHEMBL2399919 1.00 TSHR (0.88) TSHRTHRBDGKANAAAALDH1A1
Pentadecane SCHEMBL2401072 1.00 TSHR (0.88) TSHRTHRBDGKANAAAALDH1A1
SCHEMBL2401532 1.00 TSHR (0.88) TSHRTHRBDGKANAAAALDH1A1

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-8013032-B2 Photopolymerizable dental composition with suppressed change in color tone by monomer KABUSHIKI KAISHA SHOFU (JP) 2011-09-06 US disclosed
US-20090227699-A1 Photopolymerizable dental composition with suppressed change in color tone by monomer KABUSHIKI KAISHA SHOFU 2009-09-10 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-20090227699-A1 Photopolymerizable dental composition with suppressed change in color tone by monomer DNMT3A, TET1, DNMT1 TSHR 2041/4885THRB 1370/4885DGKA 3422/4885

“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.