Sugi Predict

Sugi Predict / Compounds / SCHEMBL30576702

SCHEMBL30576702

SCHEMBL30576702

CN[C@@H](C)C(=O)N[C@@H](CC(C)C)C(=O)O

nearest known ligand 0.60

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 2/20 0.60
▸ MEN1 O00255 1/20 0.56
▸ LMNA P02545 1/20 0.56
▸ KMT2A Q03164 1/20 0.56
▸ MAPT P10636 1/20 0.53
▸ FOLH1 Q04609 3/20 0.50
▸ MME P08473 6/20 0.49
▸ LAP3 P28838 3/20 0.47
▸ NAALAD2 Q9Y3Q0 1/20 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
SCHEMBL31634304 0.86 ALDH1A1 (0.62) ALDH1A1MEN1LMNAKMT2AMAPT
SCHEMBL31116669 0.86 ALDH1A1 (0.62) ALDH1A1MEN1LMNAKMT2AMAPT
SCHEMBL17305535 0.86 ALDH1A1 (0.62) ALDH1A1MEN1LMNAKMT2AMAPT
SCHEMBL9073861 0.83 ALDH1A1 (0.75) ALDH1A1MEN1LMNAKMT2AMAPT
SCHEMBL7361837 0.82 ALDH1A1 (0.67) ALDH1A1MEN1LMNAKMT2AMAPT
SCHEMBL14163018 0.82 ALDH1A1 (0.67) ALDH1A1MEN1LMNAKMT2AMAPT
SCHEMBL7361840 0.82 ALDH1A1 (0.67) ALDH1A1MEN1LMNAKMT2AMAPT
SCHEMBL23901487 0.81 ALDH1A1 (0.56) ALDH1A1MEN1LMNAKMT2AMAPT
SCHEMBL14117890 0.81 BIRC2 (0.54) FOLH1MME
SCHEMBL3157935 0.81 MAPT (0.59) ALDH1A1MEN1LMNAKMT2AMAPT

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
WO-2023171671-A1 METHOD FOR PRODUCING CYCLIC AMIDE 国立大学法人東海国立大学機構 2023-09-14 — — WO disclosed