SCHEMBL22015382

SCHEMBL22015382

Cc1cccn2c(C(C)(C)NC=O)cnc12

nearest known ligand 0.54

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
SSTR4 P31391 5/20 0.54
HDAC8 Q9BY41 1/20 0.39
MAPT P10636 4/20 0.37
KDM4E B2RXH2 4/20 0.37
TP53 P04637 3/20 0.37
RECQL P46063 1/20 0.37
NPSR1 Q6W5P4 1/20 0.37
LMNA P02545 2/20 0.37
NPC1 O15118 1/20 0.36
NR3C2 P08235 1/20 0.34
ALDH1A1 P00352 2/20 0.34
HPGD P15428 1/20 0.34

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
SCHEMBL17754876 0.76 SSTR4 (0.48) SSTR4HDAC8MAPTKDM4ETP53
SCHEMBL22015341 0.76 SSTR4 (0.53) SSTR4MAPTKDM4ETP53RECQL
SCHEMBL22015391 0.75 SSTR4 (0.51) SSTR4MAPTKDM4ERECQLNPSR1
SCHEMBL22015379 0.75 SSTR4 (0.54) SSTR4
SCHEMBL5632902 0.71 MAPT (0.47) SSTR4HDAC8MAPTKDM4ETP53
SCHEMBL1580083 0.71 MAPT (0.54) HDAC8MAPTKDM4ETP53RECQL
SCHEMBL19724571 0.70 SSTR4 (1.00) SSTR4
SCHEMBL16255852 0.70 SSTR4 (1.00) SSTR4
SCHEMBL22015969 0.69 SSTR4 (0.54) SSTR4MAPTKDM4ERECQLNPSR1
SCHEMBL19724460 0.69 SSTR4 (0.69) SSTR4

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
EP-3218372-B1 MORPHOLINE AND 1,4-OXAZEPANE AMIDES AS SOMATOSTATIN RECEPTOR SUBTYPE 4 (SSTR4) AGONISTS BOEHRINGER INGELHEIM INT (DE) 2020-05-20 EP disclosed