SCHEMBL31460922

SCHEMBL31460922

O=C(NCCN1CCC(C(=O)O)CC1)c1cccc(-c2cn3cc(C(=O)NC4CCC4)ccc3n2)c1

nearest known ligand 0.62

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
MLLT1 Q03111 1/20 0.62
HPGDS O60760 7/20 0.59
MEN1 O00255 1/20 0.44
KMT2A Q03164 1/20 0.44
CHRM4 P08173 1/20 0.44
ATR Q13535 2/20 0.43
MAP4K4 O95819 1/20 0.42
MAPT P10636 1/20 0.42
ERN1 O75460 1/20 0.42

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
SCHEMBL31460463 0.83 HPGDS (0.64) MLLT1HPGDSMAP4K4MAPT
SCHEMBL22939441 0.78 MAPT (0.64) MLLT1HPGDSMAP4K4MAPT
SCHEMBL25480030 0.76 MLLT1 (0.88) MLLT1HPGDSATRMAPT
SCHEMBL25513463 0.75 MLLT1 (0.87) MLLT1HPGDSKMT2AMAPT
SCHEMBL25483890 0.73 MLLT1 (0.84) MLLT1HPGDSKMT2AMAPT
SCHEMBL22939439 0.72 MLLT1 (0.61) MLLT1HPGDSKMT2AMAPT
SCHEMBL5342868 0.71 HPGDS (0.61) MLLT1HPGDSMEN1KMT2A
SCHEMBL25878621 0.69 RAB9A (0.57) HPGDSKMT2AATRMAPT
SCHEMBL22939414 0.68 MLLT1 (0.73) MLLT1HPGDSMAPT
SCHEMBL29882018 0.68 MLLT1 (0.73) MLLT1HPGDSMAPT

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-2025076501-A1 HIGH THROUGHPUT PARALLEL SYNTHESIS OF SMALL MOLECULE DEGRADERS THE SCRIPPS RESEARCH INSTITUTE (US) 2025-04-10 WO disclosed