SCHEMBL1421071

SCHEMBL1421071

CCCNOC(=O)N1CCCCC1

nearest known ligand 0.42

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ L3MBTL1 Q9Y468 3/20 0.42
▸ MEN1 O00255 1/20 0.42
▸ KMT2A Q03164 1/20 0.42
▸ TDP1 Q9NUW8 1/20 0.42
▸ THRB P10828 1/20 0.39
▸ ATM Q13315 1/20 0.39
▸ ALDH1A1 P00352 5/20 0.39
▸ POLB P06746 2/20 0.39
▸ LMNA P02545 1/20 0.39
▸ KDM4E B2RXH2 1/20 0.37
▸ HTT P42858 1/20 0.37
▸ SMN1; SMN2 Q16637 1/20 0.37
▸ CHRM1 P11229 2/20 0.37
▸ HPGD P15428 1/20 0.36

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
SCHEMBL28214834 0.94 ALDH1A1 (0.38) L3MBTL1MEN1KMT2ATDP1THRB
SCHEMBL18556218 0.85 ALDH1A1 (0.41) L3MBTL1MEN1KMT2ATDP1THRB
SCHEMBL4788827 0.80 CA12 (0.45) L3MBTL1MEN1KMT2AALDH1A1POLB
SCHEMBL31258481 0.80 ALDH1A1 (0.38) L3MBTL1MEN1KMT2ATDP1ATM
SCHEMBL2350666 0.76 ALDH1A1 (0.38) L3MBTL1MEN1KMT2ATDP1THRB
SCHEMBL22031687 0.76 ALDH1A1 (0.38) L3MBTL1MEN1KMT2ATDP1THRB
SCHEMBL3943182 0.76 MMP1 (0.39) L3MBTL1MEN1KMT2ATHRBATM
SCHEMBL31285979 0.75 EPHX1 (0.48) L3MBTL1MEN1KMT2ATDP1ALDH1A1
SCHEMBL29141676 0.74 ALDH1A1 (0.35) L3MBTL1THRBATMALDH1A1POLB
SCHEMBL3399580 0.74 ALDH1A1 (0.45) L3MBTL1MEN1KMT2ATHRBATM

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-2297114-A2 HETEROCYCLIC COMPOUND AND USE THEREOF Takeda Pharmaceutical Company Limited (JP) 2011-03-23 — — EP disclosed
WO-2009154300-A2 HETEROCYCLIC COMPOUND AND USE THEREOF TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2009-12-23 — — WO disclosed
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