SCHEMBL19645490

SCHEMBL19645490

CC(C)(N)CC(C)(C)C1CCCCCCCCC1

nearest known ligand 0.40

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.40
ALDH1A1 P00352 1/20 0.40
LMNA P02545 1/20 0.40
ALOX12 P18054 1/20 0.40
KMT2A Q03164 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
NPSR1 Q6W5P4 1/20 0.40
CYP1A2 P05177 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
SCHEMBL19882345 0.89 MEN1 (0.33) MEN1ALDH1A1LMNAALOX12KMT2A
SCHEMBL21709546 0.87 MEN1 (0.33) MEN1ALDH1A1LMNAALOX12KMT2A
SCHEMBL2994447 0.85 MEN1 (0.40) MEN1ALDH1A1LMNAALOX12KMT2A
SCHEMBL9843774 0.80 MEN1 (0.38) MEN1ALDH1A1LMNAALOX12KMT2A
SCHEMBL25036853 0.80 MEN1 (0.31) MEN1ALDH1A1LMNAALOX12KMT2A
SCHEMBL20761558 0.80 ALDH1A1 (0.32) ALDH1A1
Water SCHEMBL9016316 0.78 MEN1 (0.37) MEN1ALDH1A1LMNAALOX12KMT2A
SCHEMBL3002888 0.78 MEN1 (0.37) MEN1ALDH1A1LMNAALOX12KMT2A
SCHEMBL22081726 0.77 MEN1 (0.38) MEN1ALDH1A1LMNAALOX12KMT2A
SCHEMBL22081056 0.77 MEN1 (0.38) MEN1ALDH1A1LMNAALOX12KMT2A

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
US-9828346-B2 N-myristoyl transferase inhibitors UNIVERSITY OF DUNDEE (GB) 2017-11-28 US disclosed