SCHEMBL18963373

SCHEMBL18963373

CNC(=O)CSCCOCCOCCSCC(C)=O

nearest known ligand 0.39

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ CES2 O00748 1/20 0.39
▸ MAPT P10636 2/20 0.36
▸ ALDH1A1 P00352 1/20 0.36
▸ LMNA P02545 1/20 0.35
▸ KMT2A Q03164 1/20 0.35
▸ TP53 P04637 1/20 0.31
▸ HTT P42858 1/20 0.30
▸ RECQL P46063 1/20 0.30
▸ SLC6A3 Q01959 1/20 0.30

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
SCHEMBL12417416 0.81 LMNA (0.34) MAPTALDH1A1LMNAKMT2A
SCHEMBL12417421 0.81 LMNA (0.34) MAPTALDH1A1LMNAKMT2A
SCHEMBL12417418 0.81 LMNA (0.34) MAPTALDH1A1LMNAKMT2A
SCHEMBL17346842 0.80 KMT2A (0.43) CES2MAPTALDH1A1LMNAKMT2A
SCHEMBL18963318 0.79 LMNA (0.35) MAPTALDH1A1LMNAKMT2A
SCHEMBL18963320 0.74 ADRB2 (0.31) LMNA
SCHEMBL14374030 0.73 MVD (0.49) MAPTALDH1A1LMNAKMT2ATP53
SCHEMBL18963376 0.72 — —
SCHEMBL18963343 0.72 — —
SCHEMBL1864683 0.72 MEN1 (0.44) CES2MAPTALDH1A1KMT2AHTT

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-2421878-B1 ANIONIC OLIGOSACCHARIDE CONJUGATES GLYCAN BIOSCIENCES LLC (US) 2017-06-14 — — EP disclosed
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