SCHEMBL25609502

SCHEMBL25609502

N#C/C(=C\c1ccc(-c2ccc3cc(NCCN4CCOCC4)ccc3c2)s1)C(=O)NCCCO

nearest known ligand 0.47

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
LMNA P02545 3/20 0.47
ALDH1A1 P00352 4/20 0.47
KMT2A Q03164 3/20 0.47
MAPT P10636 2/20 0.42
MAPK1 P28482 1/20 0.42
EGFR P00533 2/20 0.40
HPGD P15428 2/20 0.38
PRF1 P14222 2/20 0.38
CACNA1B Q00975 1/20 0.37
APBA1 Q02410 1/20 0.37
TSHR P16473 1/20 0.37
CD274 Q9NZQ7 2/20 0.36
GAA P10253 2/20 0.36
KDM4E B2RXH2 1/20 0.36
USP9X Q93008 1/20 0.36
USP24 Q9UPU5 1/20 0.36
SCN9A Q15858 1/20 0.36
ABHD6 Q9BV23 1/20 0.35

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
SCHEMBL18220167 0.89 ALDH1A1 (0.48) LMNAALDH1A1KMT2AMAPTMAPK1
SCHEMBL17120684 0.89 LMNA (0.44) LMNAALDH1A1KMT2AMAPTMAPK1
SCHEMBL25609499 0.87 KMT2A (0.41) LMNAALDH1A1KMT2AMAPTMAPK1
SCHEMBL18220274 0.87 KMT2A (0.45) LMNAALDH1A1KMT2AMAPTMAPK1
SCHEMBL17120832 0.87 APP (0.43) LMNAALDH1A1KMT2AMAPTMAPK1
SCHEMBL25609471 0.85 ALDH1A1 (0.42) LMNAALDH1A1KMT2AMAPTMAPK1
SCHEMBL18221569 0.84 LMNA (0.41) LMNAALDH1A1KMT2AMAPTMAPK1
SCHEMBL25611400 0.84 LMNA (0.41) LMNAALDH1A1KMT2AMAPTMAPK1
SCHEMBL24075923 0.84 LMNA (0.41) LMNAALDH1A1KMT2AMAPTMAPK1
SCHEMBL25611396 0.84 LMNA (0.41) LMNAALDH1A1KMT2AMAPTMAPK1

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