SCHEMBL21884793

SCHEMBL21884793

Cc1cccc(-c2c(C#N)ccc(O)c2C(=O)N=C2NCCN2)c1Cl

nearest known ligand 0.31

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.31
LMNA P02545 1/20 0.31
GAA P10253 1/20 0.31
HPGD P15428 1/20 0.31
HTT P42858 1/20 0.31
KMT2A Q03164 1/20 0.31
NISCH Q9Y2I1 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
SCHEMBL21884531 0.91 PDK2 (0.32)
SCHEMBL23854884 0.88 PDK2 (0.31)
SCHEMBL21884532 0.87 PGR (0.35) MEN1KMT2A
SCHEMBL21884537 0.86 AR (0.31)
SCHEMBL21884490 0.85 PIM1 (0.35) MEN1LMNAGAAHPGDHTT
SCHEMBL21884540 0.84 GAA (0.33) GAA
SCHEMBL23854864 0.84
SCHEMBL23854855 0.83 KDM4E (0.32) LMNAHPGDHTT
SCHEMBL23854839 0.82 MKNK1 (0.32) GAANISCH
SCHEMBL21884539 0.82 USP30 (0.34)

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-2020061473-A1 SMALL MOLECULES TARGETING MUTANT MAMMALIAN PROTEINS JNANA THERAPEUTICS, INC. (US) 2020-03-26 WO disclosed