SCHEMBL20458247

SCHEMBL20458247

CCc1nc(NC(O)[C@@H]2CCN2C(=O)OC(C)(C)C)nn1-c1ccccc1

nearest known ligand 0.40

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
LMNA P02545 4/20 0.40
THRB P10828 2/20 0.40
POLB P06746 1/20 0.40
GPR119 Q8TDV5 2/20 0.38
MAPT P10636 2/20 0.38
TP53 P04637 4/20 0.37
NR1H3 Q13133 3/20 0.37
NR1H2 P55055 2/20 0.37
TDP1 Q9NUW8 1/20 0.36
GAA P10253 1/20 0.35
KDM4E B2RXH2 1/20 0.35
PKM P14618 1/20 0.35

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
SCHEMBL9892924 0.82 MEN1 (0.48) LMNATHRBPOLBGPR119MAPT
SCHEMBL13257808 0.78 MEN1 (0.52) LMNATHRBPOLBKDM4E
SCHEMBL9892268 0.74 POLB (0.51) LMNATHRBPOLBMAPT
SCHEMBL20458149 0.74 ALDH1A1 (0.46) MAPTGAA
SCHEMBL9108039 0.73 HTRA1 (0.40) LMNATHRBPOLBMAPT
SCHEMBL20458171 0.71 L3MBTL1 (0.48) POLBGPR119MAPTGAA
SCHEMBL25337486 0.69 GPR119 (0.46) LMNAGPR119MAPTNR1H3NR1H2
SCHEMBL20595761 0.69 GPR119 (0.46) LMNAGPR119MAPTNR1H3NR1H2
SCHEMBL20458202 0.67 ATAD2 (0.47) LMNAPOLBMAPTTDP1KDM4E
SCHEMBL20458254 0.67 GRM5 (0.36) LMNAGPR119MAPTNR1H3NR1H2

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-2443107-B1 AZETIDINE 2 -CARBOXAMIDE DERIVATIVES WHICH MODULATE THE CB2 RECEPTOR BOEHRINGER INGELHEIM INT (DE) 2018-08-08 EP disclosed