Undecane

Undecane

SCHEMBL28077638

CCC(=O)OC(C)C.CCCCCCCCCCC

nearest known ligand 0.73

Full drug profile on Sugi Atlas →

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
LMNA P02545 3/20 0.73
NAAA Q02083 1/20 0.54
MAPT P10636 2/20 0.47
MAPK1 P28482 1/20 0.47
ALDH1A1 P00352 1/20 0.44
DGKA P23743 1/20 0.43
FAAH O00519 4/20 0.43
CNR1 P21554 1/20 0.43
CNR2 P34972 1/20 0.43
TSHR P16473 1/20 0.41
CES2 O00748 3/20 0.41
CES1 P23141 3/20 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
SCHEMBL27845849 1.00 LMNA (0.73) LMNANAAAMAPTMAPK1ALDH1A1
Hexadecane SCHEMBL27628780 1.00 LMNA (0.73) LMNANAAAMAPTMAPK1ALDH1A1
SCHEMBL28102378 1.00 LMNA (0.73) LMNANAAAMAPTMAPK1ALDH1A1
Tetradecane SCHEMBL27447005 1.00 LMNA (0.73) LMNANAAAMAPTMAPK1ALDH1A1
SCHEMBL27805562 0.92 LMNA (0.89) LMNAMAPTMAPK1ALDH1A1DGKA
Isopropyl Palmitate SCHEMBL28074359 0.92 LMNA (0.89) LMNAMAPTMAPK1ALDH1A1DGKA
SCHEMBL28116935 0.90 LMNA (0.61) LMNANAAAMAPTMAPK1ALDH1A1
SCHEMBL27897918 0.90 LMNA (0.61) LMNANAAAMAPTMAPK1FAAH
Butane SCHEMBL29166845 0.88 LMNA (0.56) LMNANAAAMAPTMAPK1ALDH1A1
SCHEMBL31019825 0.88 LMNA (0.54) LMNANAAAMAPTALDH1A1TSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-105765017-A Reversible pressure-sensitive adhesive mass 德莎欧洲公司 2016-07-13 CN disclosed