SCHEMBL14655871

SCHEMBL14655871

CCCCCC(O)[CH]CCCCCO

nearest known ligand 0.50

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
LMNA P02545 3/20 0.50
ALDH1A1 P00352 1/20 0.50
HSD17B10 Q99714 1/20 0.50
MEN1 O00255 1/20 0.50
KMT2A Q03164 1/20 0.50
TSHR P16473 1/20 0.50
SMN1; SMN2 Q16637 1/20 0.46
PPARG P37231 2/20 0.43
TRPA1 O75762 1/20 0.43
DDAH1 O94760 1/20 0.43
GAPDH P04406 1/20 0.43
MAPT P10636 1/20 0.43
GPR132 Q9UNW8 1/20 0.43
FAAH O00519 1/20 0.43

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
SCHEMBL11191795 0.92 LMNA (0.44) LMNAALDH1A1HSD17B10MEN1KMT2A
SCHEMBL28852289 0.92 TRPA1 (0.48) LMNAPPARGTRPA1DDAH1GAPDH
SCHEMBL27644434 0.92 TRPA1 (0.48) LMNAPPARGTRPA1DDAH1GAPDH
SCHEMBL28131157 0.92 TRPA1 (0.48) LMNAPPARGTRPA1DDAH1GAPDH
SCHEMBL8434341 0.92 TRPA1 (0.48) LMNAPPARGTRPA1DDAH1GAPDH
SCHEMBL8437504 0.92 TRPA1 (0.48) LMNAPPARGTRPA1DDAH1GAPDH
SCHEMBL27828958 0.92 TRPA1 (0.48) LMNAPPARGTRPA1DDAH1GAPDH
SCHEMBL29013305 0.88 LMNA (0.42) LMNAALDH1A1HSD17B10MEN1KMT2A
SCHEMBL29013339 0.88 LMNA (0.42) LMNAALDH1A1HSD17B10MEN1KMT2A
SCHEMBL29013338 0.88 LMNA (0.42) LMNAALDH1A1HSD17B10MEN1KMT2A

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
EP-1778712-B1 2-PROPYNYL ADENOSINE ANALOGS WITH MODIFIED 5'-RIBOSE GROUPS HAVING A2A AGONIST ACTIVITY Univ Virginia Patent Found (US) 2013-01-30 EP disclosed