SCHEMBL3402648

SCHEMBL3402648

Cc1cccc(-n2nc(C)c(C(=O)N3CCC(N4CCCCC4)CC3)c2C)c1C

nearest known ligand 0.46

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
L3MBTL3 Q96JM7 14/20 0.46
L3MBTL1 Q9Y468 12/20 0.46
MBTD1 Q05BQ5 6/20 0.46
TP53BP1 Q12888 3/20 0.45
CCR5 P51681 2/20 0.45
MEN1 O00255 3/20 0.45
KMT2A Q03164 3/20 0.45
LMNA P02545 2/20 0.45
ALDH1A1 P00352 1/20 0.45
GAA P10253 1/20 0.45
MAPT P10636 1/20 0.45
PKM P14618 1/20 0.45
NPSR1 Q6W5P4 1/20 0.45
L3MBTL4 Q8NA19 2/20 0.44

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
SCHEMBL3403915 0.91 KMT2A (0.48) L3MBTL3L3MBTL1CCR5MEN1KMT2A
SCHEMBL3400065 0.82 L3MBTL3 (0.48) L3MBTL3L3MBTL1MBTD1TP53BP1MEN1
SCHEMBL3404126 0.82 L3MBTL3 (0.48) L3MBTL3L3MBTL1MBTD1TP53BP1MEN1
SCHEMBL3405473 0.82 KDM4E (0.47) L3MBTL3L3MBTL1CCR5MEN1KMT2A
SCHEMBL2202742 0.79 KMT2A (0.50) L3MBTL3L3MBTL1MBTD1TP53BP1MEN1
SCHEMBL3401127 0.78 LMNA (0.50) L3MBTL1MEN1KMT2ALMNAALDH1A1
Hydrochloric Acid SCHEMBL2201681 0.78 KMT2A (0.51) L3MBTL3L3MBTL1MBTD1TP53BP1KMT2A
SCHEMBL2201429 0.77 KMT2A (0.46) L3MBTL3L3MBTL1MEN1KMT2ALMNA
SCHEMBL2201747 0.76 KMT2A (0.47) L3MBTL3L3MBTL1MEN1KMT2ALMNA
SCHEMBL2200707 0.76 KMT2A (0.52) L3MBTL3L3MBTL1MBTD1MEN1KMT2A

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-7728009-B1 Thiazole amides, imidazole amides and related analogues NEUROGEN CORPORATION (US) 2010-06-01 US disclosed