SCHEMBL11567697

SCHEMBL11567697

CC(C)CC(NC(=O)C(NC(=O)C(N)C(C)O)C(C)C)C(=O)O

nearest known ligand 0.47

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 2/20 0.47
▸ LAP3 P28838 3/20 0.46
▸ MEN1 O00255 1/20 0.45
▸ LMNA P02545 1/20 0.45
▸ KMT2A Q03164 1/20 0.45
▸ MAPT P10636 1/20 0.43
▸ BACE1 P56817 3/20 0.41
▸ CTSD P07339 1/20 0.41
▸ FOLH1 Q04609 2/20 0.41
▸ MME P08473 1/20 0.41
▸ BACE2 Q9Y5Z0 1/20 0.39

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
SCHEMBL11567194 1.00 ALDH1A1 (0.47) ALDH1A1LAP3MEN1LMNAKMT2A
SCHEMBL11566787 1.00 ALDH1A1 (0.47) ALDH1A1LAP3MEN1LMNAKMT2A
SCHEMBL11567184 1.00 ALDH1A1 (0.47) ALDH1A1LAP3MEN1LMNAKMT2A
SCHEMBL11566796 1.00 ALDH1A1 (0.47) ALDH1A1LAP3MEN1LMNAKMT2A
SCHEMBL30052089 0.91 ALDH1A1 (0.50) ALDH1A1LAP3MEN1LMNAKMT2A
SCHEMBL14842720 0.91 ALDH1A1 (0.56) ALDH1A1LAP3MEN1LMNAKMT2A
SCHEMBL14842719 0.91 ALDH1A1 (0.56) ALDH1A1LAP3MEN1LMNAKMT2A
SCHEMBL31174338 0.91 ALDH1A1 (0.56) ALDH1A1LAP3MEN1LMNAKMT2A
SCHEMBL29531441 0.91 ALDH1A1 (0.56) ALDH1A1LAP3MEN1LMNAKMT2A
SCHEMBL28724482 0.91 ALDH1A1 (0.56) ALDH1A1LAP3MEN1LMNAKMT2A

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
US-4146614-A TREATMENT OF SCHIZOPHRENIA STATE OF MICHIGAN (US) 1979-03-27 — — US disclosed
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