SCHEMBL31258268

SCHEMBL31258268

CC(C)(C)OC(=O)NCCC(=O)NCCC(=O)NCCC(=O)OCc1ccccc1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SYK P43405 1/20 0.53
IDO1 P14902 1/20 0.52
SIGMAR1 Q99720 2/20 0.50
MEN1 O00255 4/20 0.48
KMT2A Q03164 4/20 0.48
HTT P42858 1/20 0.48
L3MBTL1 Q9Y468 2/20 0.47
LMNA P02545 1/20 0.47
SMN1; SMN2 Q16637 1/20 0.47
MAPT P10636 1/20 0.47
CYP3A4 P08684 1/20 0.47
HDAC3 O15379 1/20 0.45
HDAC4 P56524 1/20 0.45
HDAC1 Q13547 1/20 0.45
HDAC7 Q8WUI4 1/20 0.45
HDAC2 Q92769 1/20 0.45
HDAC10 Q969S8 1/20 0.45
HDAC11 Q96DB2 1/20 0.45
HDAC8 Q9BY41 1/20 0.45
HDAC6 Q9UBN7 1/20 0.45

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
SCHEMBL7308592 1.00 SYK (0.53) SYKIDO1SIGMAR1MEN1KMT2A
SCHEMBL3955009 0.95 SYK (0.57) SYKIDO1SIGMAR1MEN1KMT2A
SCHEMBL7298164 0.94 HTT (0.54) SYKIDO1SIGMAR1HTTL3MBTL1
SCHEMBL7310718 0.93 CYP3A4 (0.56) SYKIDO1SIGMAR1HTTL3MBTL1
SCHEMBL23518513 0.91 SYK (0.52) SYKIDO1SIGMAR1MEN1KMT2A
SCHEMBL5574078 0.91 SYK (0.57) SYKIDO1SIGMAR1MEN1KMT2A
SCHEMBL23748130 0.90 SYK (0.51) SYKIDO1SIGMAR1MEN1KMT2A
SCHEMBL29055947 0.90 SYK (0.51) SYKIDO1SIGMAR1MEN1KMT2A
SCHEMBL20703250 0.89 SYK (0.54) SYKIDO1SIGMAR1MEN1KMT2A
SCHEMBL17599919 0.88 CYP3A4 (0.59) SYKIDO1SIGMAR1MEN1KMT2A

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4695227-A1 MASS SPECTROMETRIC ANALYSIS Electrophoretics Limited (GB) 2026-02-18 EP disclosed
WO-2024214049-A1 MASS SPECTROMETRIC ANALYSIS ELECTROPHORETICS LIMITED (GB) 2024-10-17 WO disclosed