SCHEMBL19371532

SCHEMBL19371532

CC(C)CC[C@@H](NC(C)C)C(=O)C(C)C

nearest known ligand 0.33

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ CA1 P00915 2/20 0.33
▸ MEN1 O00255 1/20 0.31
▸ ALDH1A1 P00352 1/20 0.31
▸ LMNA P02545 1/20 0.31
▸ KMT2A Q03164 1/20 0.31
▸ SLC1A3 P43003 1/20 0.31
▸ SLC1A2 P43004 1/20 0.31
▸ SLC1A1 P43005 1/20 0.31
▸ GAA P10253 1/20 0.30
▸ RAB9A P51151 1/20 0.30
▸ SMN1; SMN2 Q16637 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
SCHEMBL18494037 1.00 CA1 (0.33) CA1MEN1ALDH1A1LMNAKMT2A
SCHEMBL18494032 0.88 BLM (0.38) CA1LMNA
SCHEMBL24221039 0.86 KDM4C (0.38) CA1LMNA
SCHEMBL21166859 0.84 CA1 (0.34) CA1MEN1ALDH1A1LMNAKMT2A
SCHEMBL19483467 0.83 — —
SCHEMBL24221392 0.83 HDAC7 (0.35) MEN1KMT2ARAB9A
SCHEMBL10166039 0.83 HDAC7 (0.35) MEN1KMT2ARAB9A
SCHEMBL22215874 0.81 — —
SCHEMBL21166946 0.81 GABRR1 (0.40) —
SCHEMBL21216094 0.81 — —

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-2017161206-A1 CONJUGATES CONTAINING CONDITIONALLY ACTIVE ANTIBODIES OR ANTIGEN-BINDING FRAGMENTS THEREOF, AND METHODS OF USE HALOZYME, INC. (US) 2017-09-21 — — WO disclosed
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