Pentadecane

Pentadecane

SCHEMBL9703154

CC1CCC(C)C(C)C1.CCCCCCCCCCCCCCC

nearest known ligand 0.38

Full drug profile on Sugi Atlas →

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.38
THRB P10828 1/20 0.38
EPHX1 P07099 1/20 0.35
FUCA1 P04066 8/20 0.35
ALDH1A1 P00352 2/20 0.33
OPRM1 P35372 1/20 0.33
EBP Q15125 1/20 0.32
SIGMAR1 Q99720 1/20 0.32
TDP1 Q9NUW8 1/20 0.32

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
SCHEMBL6130364 0.82
SCHEMBL598788 0.82
SCHEMBL6130352 0.82
SCHEMBL6130362 0.82
SCHEMBL13580286 0.82
SCHEMBL598049 0.82
SCHEMBL134313 0.82
SCHEMBL31122647 0.79 ALOX5 (0.42) TSHRTHRBEPHX1FUCA1ALDH1A1
SCHEMBL21328574 0.76 L3MBTL1 (0.35)
SCHEMBL11903803 0.73 CYP1A2 (0.37)

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
US-5128262-A Biosurfactant WINTERSHELL AG (DE) 1992-07-07 US disclosed