SCHEMBL4356808

SCHEMBL4356808

CCOC(=O)N1CCC(C2OCc3cc(-c4ccc(C(=O)N5CCN(C)CC5)cc4)ccc3O2)CC1

nearest known ligand 0.45

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
SETD7 Q8WTS6 1/20 0.45
KMT2A Q03164 4/20 0.44
CYP2C19 P33261 3/20 0.44
MEN1 O00255 3/20 0.43
GAA P10253 2/20 0.43
KDM4E B2RXH2 1/20 0.43
HPGD P15428 1/20 0.43
NPSR1 Q6W5P4 2/20 0.42
POLB P06746 2/20 0.42
ALDH1A1 P00352 3/20 0.41
CNR2 P34972 1/20 0.41
HTT P42858 1/20 0.40
GPR119 Q8TDV5 1/20 0.40
ROCK2 O75116 1/20 0.40
LMNA P02545 1/20 0.39
CACNA1B Q00975 1/20 0.39
APBA1 Q02410 1/20 0.39
CYP1A2 P05177 1/20 0.39

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
SCHEMBL4352615 0.91 POLB (0.39) SETD7KMT2ACYP2C19MEN1GAA
SCHEMBL4524446 0.90 GPR119 (0.40) SETD7KMT2ACYP2C19MEN1GAA
SCHEMBL4355704 0.90 RAB9A (0.46) SETD7KMT2ACYP2C19MEN1GAA
SCHEMBL4360439 0.89 TSHR (0.44) KMT2AMEN1GAAKDM4EHPGD
SCHEMBL13586034 0.89 ABL1 (0.46) KMT2AMEN1POLBCNR2GPR119
SCHEMBL4357683 0.88 POLB (0.48) HPGDPOLBALDH1A1GPR119ROCK2
SCHEMBL4355595 0.88 POLB (0.54) CYP2C19HPGDPOLBALDH1A1LMNA
SCHEMBL4534565 0.87 KDM4E (0.40) KMT2AGAAKDM4EHPGDALDH1A1
SCHEMBL4348683 0.87 TNKS (0.41) KMT2AMEN1NPSR1HTTLMNA
SCHEMBL4531625 0.86 ALDH1A1 (0.40) GAAKDM4ENPSR1ALDH1A1LMNA

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