SCHEMBL4352615

SCHEMBL4352615

CN1CCN(C(=O)c2ccc(-c3ccc4c(c3)COC(C3CCN(C(=O)OCC5(C)CC5)CC3)O4)cc2)CC1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
POLB P06746 2/20 0.39
GPR119 Q8TDV5 1/20 0.38
ROCK2 O75116 1/20 0.38
HPGD P15428 4/20 0.36
SETD7 Q8WTS6 1/20 0.36
L3MBTL3 Q96JM7 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
OTUD7B Q6GQQ9 1/20 0.36
KMT2A Q03164 2/20 0.35
CHKA P35790 1/20 0.35
MEN1 O00255 1/20 0.35
KCNH2 Q12809 2/20 0.35
PDE5A O76074 1/20 0.35
PDE4A P27815 1/20 0.35
PDE1A P54750 1/20 0.35
PDE1B Q01064 1/20 0.35
PDE4B Q07343 1/20 0.35
PDE4C Q08493 1/20 0.35
PDE4D Q08499 1/20 0.35
PDE7A Q13946 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
SCHEMBL4356470 0.92 GPR119 (0.38) GPR119SETD7L3MBTL1KMT2AMEN1
SCHEMBL4356808 0.91 SETD7 (0.45) POLBGPR119ROCK2HPGDSETD7
SCHEMBL4534628 0.90 GPR119 (0.40) GPR119
SCHEMBL4522943 0.88 ALDH1A1 (0.36) GPR119ROCK2HPGDKMT2AMEN1
SCHEMBL4353425 0.88 SCD5 (0.36) GPR119OTUD7BKCNH2KDM4EHRH3
SCHEMBL4350015 0.86 GPR119 (0.41) GPR119KMT2AMEN1KCNH2GAA
SCHEMBL4353651 0.86 KCNH2 (0.38) ROCK2HPGDKMT2AMEN1KCNH2
SCHEMBL4350129 0.85 KDM4E (0.37) GPR119KDM4E
SCHEMBL13586034 0.85 ABL1 (0.46) POLBGPR119ROCK2KMT2AMEN1
SCHEMBL4357683 0.84 POLB (0.48) POLBGPR119ROCK2HPGDL3MBTL3

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
WO-2009150144-A1 NEW GPR119MODULATORS INOVACIA AB (SE) 2009-12-17 WO disclosed
WO-2009150144-A1 NEW GPR119MODULATORS INOVACIA AB (SE) 2009-12-17 WO disclosed