SCHEMBL4948489

SCHEMBL4948489

CCCSc1ncccc1C(=O)NC1CCCCn2c1nc(-c1ccncc1)cc2=O

nearest known ligand 0.54

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
HSD11B1 P28845 13/20 0.54
RAB9A P51151 1/20 0.39
HTT P42858 1/20 0.38
ALDH1A1 P00352 2/20 0.38
MEN1 O00255 1/20 0.38
KMT2A Q03164 1/20 0.38
L3MBTL1 Q9Y468 1/20 0.38
CNR1 P21554 1/20 0.37
CNR2 P34972 1/20 0.37

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
SCHEMBL4385766 0.89 RAB9A (0.51) HSD11B1RAB9AHTTALDH1A1MEN1
SCHEMBL4386485 0.88 HSD11B1 (0.51) HSD11B1RAB9AALDH1A1MEN1KMT2A
SCHEMBL4386498 0.86 ALDH1A1 (0.54) HSD11B1RAB9AHTTALDH1A1MEN1
SCHEMBL4377829 0.84 ALDH1A1 (0.45) HSD11B1RAB9AHTTALDH1A1MEN1
SCHEMBL4952879 0.83 MEN1 (0.47) ALDH1A1MEN1KMT2AL3MBTL1CNR1
SCHEMBL4391863 0.83 MAPT (0.40) RAB9AALDH1A1MEN1KMT2ACNR1
SCHEMBL4391283 0.83 CYP2C9 (0.39) ALDH1A1MEN1KMT2AL3MBTL1CNR1
SCHEMBL4383616 0.81 MEN1 (0.47) ALDH1A1MEN1KMT2AL3MBTL1CNR1
SCHEMBL3376845 0.79 HCRTR2 (0.46) ALDH1A1MEN1KMT2A
SCHEMBL4387186 0.79 L3MBTL1 (0.56) MEN1KMT2AL3MBTL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1939187-A1 Substituted heteroaryl pyridopyrimidone derivatives Sanofi-Aventis (FR) 2008-07-02 EP claimed
US-8198287-B2 Substituted heteroaryl pyridopyrimidone derivatives SANOFI-AVENTIS (FR) 2012-06-12 US disclosed
EP-1939187-A1 Substituted heteroaryl pyridopyrimidone derivatives Sanofi-Aventis (FR) 2008-07-02 EP disclosed