SCHEMBL25611396

SCHEMBL25611396

N#C/C(=C\c1ccc(-c2ccc3cc(NCCN4CCOCC4)ccc3c2)s1)C(=O)NCC1CC(O)CC(O)O1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.41
KMT2A Q03164 3/20 0.40
ALDH1A1 P00352 2/20 0.40
MAPT P10636 2/20 0.38
MAPK1 P28482 1/20 0.38
KDM4E B2RXH2 1/20 0.35
NPC1 O15118 1/20 0.35
POLB P06746 1/20 0.35
IDE P14735 1/20 0.35
CYP1A2 P05177 1/20 0.34
CACNA1B Q00975 1/20 0.33
APBA1 Q02410 1/20 0.33
USP9X Q93008 1/20 0.33
USP24 Q9UPU5 1/20 0.33
GAA P10253 1/20 0.33
CD274 Q9NZQ7 2/20 0.33
MCHR1 Q99705 1/20 0.32
PRF1 P14222 2/20 0.32
SCN9A Q15858 1/20 0.32
ABHD6 Q9BV23 1/20 0.32

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
SCHEMBL25608573 0.87 ALDH1A1 (0.50) LMNAKMT2AALDH1A1MAPTMAPK1
SCHEMBL25611819 0.87 ALDH1A1 (0.52) LMNAKMT2AALDH1A1MAPTMAPK1
SCHEMBL25612395 0.86 KMT2A (0.41) LMNAKMT2AALDH1A1MAPTMAPK1
SCHEMBL18221569 0.86 LMNA (0.41) LMNAKMT2AALDH1A1MAPTMAPK1
SCHEMBL25611400 0.84 LMNA (0.41) LMNAKMT2AALDH1A1MAPTMAPK1
SCHEMBL25608723 0.84 ALDH1A1 (0.57) LMNAKMT2AALDH1A1MAPTMAPK1
SCHEMBL18220315 0.84 ALDH1A1 (0.41) LMNAKMT2AALDH1A1MAPTMAPK1
SCHEMBL24075923 0.84 LMNA (0.41) LMNAKMT2AALDH1A1MAPTMAPK1
SCHEMBL25609502 0.84 LMNA (0.47) LMNAKMT2AALDH1A1MAPTMAPK1
SCHEMBL18220167 0.82 ALDH1A1 (0.48) LMNAKMT2AALDH1A1MAPTMAPK1

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
EP-3119761-B1 AMYLOID TARGETING AGENTS AND METHODS OF USING THE SAME AMYDIS DIAGNOSTICS INC (US) 2023-06-07 EP disclosed