Tridecane

Tridecane

SCHEMBL28850688

CCCC.CCCCCCCCCCCCC.CCCCCCCCCCCCC.CCCCCCCCCCCCC.CCCCCCCCCCCCC.OP(O)O.OP(O)O

nearest known ligand 0.61

Full drug profile on Sugi Atlas →

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
TSHR P16473 3/20 0.61
THRB P10828 1/20 0.61
LMNA P02545 2/20 0.53
ALDH1A1 P00352 2/20 0.53
MEN1 O00255 2/20 0.53
KMT2A Q03164 2/20 0.53
HSD17B10 Q99714 1/20 0.53
DNM1 Q05193 7/20 0.47
SMN1; SMN2 Q16637 1/20 0.47
CES2 O00748 3/20 0.45
CES1 P23141 3/20 0.45
SLC22A1 O15245 1/20 0.44

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
Dodecane SCHEMBL28210228 0.96 TSHR (0.67) TSHRTHRBLMNAALDH1A1MEN1
Tridecane SCHEMBL28086770 0.96 TSHR (0.67) TSHRTHRBLMNAALDH1A1MEN1
Hexadecane SCHEMBL27588041 0.96 TSHR (0.67) TSHRTHRBLMNAALDH1A1MEN1
Tridecane SCHEMBL4444374 0.96 TSHR (0.67) TSHRTHRBLMNAALDH1A1MEN1
Octane SCHEMBL28365096 0.96 TSHR (0.67) TSHRTHRBLMNAALDH1A1MEN1
SCHEMBL28360463 0.96 TSHR (0.67) TSHRTHRBLMNAALDH1A1MEN1
Undecane SCHEMBL8008785 0.96 TSHR (0.67) TSHRTHRBLMNAALDH1A1MEN1
Tridecane SCHEMBL11657953 0.96 TSHR (0.67) TSHRTHRBLMNAALDH1A1MEN1
Hexadecane SCHEMBL28356675 0.96 TSHR (0.67) TSHRTHRBLMNAALDH1A1MEN1
Tridecane SCHEMBL28481485 0.92 TSHR (0.61) TSHRTHRBLMNAALDH1A1MEN1

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-115119512-A Thermoplastic resin composition, method for producing the same, and molded article comprising the same 株式会社LG化学 2022-09-27 CN disclosed