SCHEMBL8091272

SCHEMBL8091272

O=C(O)CCCCCCCCCCCC[N+](=O)[O-]

nearest known ligand 0.65

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 4/20 0.65
MEN1 O00255 3/20 0.65
KMT2A Q03164 3/20 0.65
BLM P54132 1/20 0.65
HBB P68871 1/20 0.65
HIF1A Q16665 1/20 0.65
TSHR P16473 5/20 0.57
NFKB1 P19838 1/20 0.57
PMP22 Q01453 1/20 0.57
ALDH1A1 P00352 4/20 0.50
GPR84 Q9NQS5 7/20 0.48
FFAR1 O14842 2/20 0.48
FFAR4 Q5NUL3 2/20 0.48
HSD17B10 Q99714 2/20 0.46
CYP1A2 P05177 1/20 0.46
CYP2D6 P10635 1/20 0.46
MAPT P10636 1/20 0.46
CYP2C9 P11712 1/20 0.46
CYP2C19 P33261 1/20 0.46
PPARG P37231 6/20 0.46

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
SCHEMBL504353 1.00 LMNA (0.65) LMNAMEN1KMT2ABLMHBB
SCHEMBL2371134 1.00 LMNA (0.65) LMNAMEN1KMT2ABLMHBB
SCHEMBL2370652 1.00 LMNA (0.65) LMNAMEN1KMT2ABLMHBB
SCHEMBL1119124 1.00 LMNA (0.65) LMNAMEN1KMT2ABLMHBB
SCHEMBL2371891 1.00 LMNA (0.65) LMNAMEN1KMT2ABLMHBB
SCHEMBL2372027 1.00 LMNA (0.65) LMNAMEN1KMT2ABLMHBB
SCHEMBL2371874 1.00 LMNA (0.65) LMNAMEN1KMT2ABLMHBB
SCHEMBL5828245 1.00 LMNA (0.65) LMNAMEN1KMT2ABLMHBB
SCHEMBL2380101 1.00 LMNA (0.65) LMNAMEN1KMT2ABLMHBB
SCHEMBL11701621 1.00 LMNA (0.65) LMNAMEN1KMT2ABLMHBB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6048989-A PARASITICIDES AND ANTIBROTOZOA AGENTS WASHINGTON UNIVERSITY (US) 2000-04-11 US disclosed
US-6025511-A A MYRISTIC ACID SELECTED ANALOGS FOR INHIBITING THE BIOSYNTHESIS OF THE GLYCOSYL PHOSPHATIDYLINOSITOL (GPI) ANCHOR OF THE PARASITE WASHINGTON UNIVERSITY (US) 2000-02-15 US disclosed
US-6001869-A CONTACTING THE PARASITE WITH 2-THIENYL-UNDECENOIC ACID/10-/ WASHINGTON UNIVERSITY (US) 1999-12-14 US disclosed
US-5998642-A Thienyl-containing fatty acid glycosyl phosphatidylinosital analogues used for inhibiting parasitic activity WASHINGTON UNIVERSITY (US) 1999-12-07 US disclosed
US-5760259-A MYRISTIC ACID DERIVATIVES CAPABLE OF INHIBITING BIOSYNTHESIS OF PARASITE'S ANCHORING GROUP WASHINGTON UNIVERSITY (US) 1998-06-02 US disclosed
US-5747537-A Method of inhibiting parasitic activity WASHINGTON UNIVERSITY (US) 1998-05-05 US disclosed