SCHEMBL2484625

SCHEMBL2484625

CCCCOC(=O)NOCC(N)=O

nearest known ligand 0.47

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
EPHX1 P07099 1/20 0.47
RAB9A P51151 2/20 0.46
NPC1 O15118 1/20 0.46
SMN1; SMN2 Q16637 1/20 0.46
ACHE P22303 14/20 0.46
ALDH1A1 P00352 1/20 0.45
MAPT P10636 1/20 0.44
NPSR1 Q6W5P4 1/20 0.44
ATM Q13315 1/20 0.42
HPGD P15428 1/20 0.40
TSHR P16473 1/20 0.40

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
SCHEMBL7769869 0.85 EPHX1 (0.47) EPHX1RAB9ANPC1SMN1; SMN2ACHE
SCHEMBL6576436 0.84 EPHX1 (0.53) EPHX1RAB9ANPC1SMN1; SMN2ACHE
SCHEMBL2484624 0.84 EPHX1 (0.46) EPHX1RAB9ANPC1SMN1; SMN2ACHE
SCHEMBL28481312 0.82 EPHX1 (0.52) EPHX1RAB9ANPC1SMN1; SMN2ACHE
SCHEMBL4957666 0.76 EPHX1 (0.50) EPHX1RAB9ANPC1SMN1; SMN2ACHE
SCHEMBL2650736 0.76 ACHE (0.56) EPHX1RAB9ANPC1SMN1; SMN2ACHE
SCHEMBL1136659 0.75 SMN1; SMN2 (0.45) EPHX1RAB9ANPC1SMN1; SMN2ACHE
SCHEMBL4451188 0.75 RAB9A (0.61) EPHX1RAB9ANPC1SMN1; SMN2ACHE
SCHEMBL283132 0.74
SCHEMBL9565516 0.74 RAB9A (0.43) EPHX1RAB9ANPC1SMN1; SMN2ACHE

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2376123-A2 OLIGOSACCHARIDE-PROTEIN CONJUGATES Genzyme Corporation (US) 2011-10-19 EP disclosed
WO-2010075010-A2 OLIGOSACCHARIDE-PROTEIN CONJUGATES GENZYME CORPORATION (US) 2010-07-01 WO disclosed
EP-1115740-A1 SYNTHETIC PEPTIDES, CONJUGATION REAGENTS AND METHODS The Regents of the University of California (US) 2001-07-18 EP disclosed
WO-2000017226-A1 SYNTHETIC PEPTIDES, CONJUGATION REAGENTS AND METHODS THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2000-03-30 WO disclosed