SCHEMBL4355704

SCHEMBL4355704

CCOC(=O)N1CCC(C2OCc3cc(-c4ccc(C(=O)N5CCN(C)CC5)cn4)ccc3O2)CC1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 1/20 0.46
KMT2A Q03164 3/20 0.40
MEN1 O00255 2/20 0.40
STAT3 P40763 1/20 0.40
NPSR1 Q6W5P4 1/20 0.40
FLT3 P36888 1/20 0.40
TYRO3 Q06418 1/20 0.40
MERTK Q12866 1/20 0.40
GAS6 Q14393 1/20 0.40
ALDH1A1 P00352 3/20 0.40
GAA P10253 2/20 0.40
HPGD P15428 1/20 0.40
SETD7 Q8WTS6 1/20 0.39
HRH3 Q9Y5N1 4/20 0.39
ROCK2 O75116 1/20 0.39
CYP2C19 P33261 2/20 0.38
POLB P06746 1/20 0.38
CACNA1B Q00975 1/20 0.38
APBA1 Q02410 1/20 0.38
ATR Q13535 1/20 0.38

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
SCHEMBL4356808 0.90 SETD7 (0.45) KMT2AMEN1NPSR1ALDH1A1GAA
SCHEMBL4354311 0.90 GPR119 (0.44) STAT3ROCK2
SCHEMBL4536116 0.89 STAT3 (0.43) STAT3FLT3TYRO3MERTKGAS6
SCHEMBL4532442 0.87 STAT3 (0.43) STAT3FLT3TYRO3MERTKGAS6
SCHEMBL4348683 0.86 TNKS (0.41) RAB9AKMT2AMEN1NPSR1MAPT
SCHEMBL4355713 0.85 SLC6A7 (0.44) STAT3ALDH1A1KDM4E
SCHEMBL4351360 0.84 GPR119 (0.42) STAT3HRH3
SCHEMBL4347903 0.83 GPR119 (0.44) HRH3
SCHEMBL4525904 0.82 HRH3 (0.40) STAT3ALDH1A1HRH3POLB
SCHEMBL4352615 0.81 POLB (0.39) KMT2AMEN1GAAHPGDSETD7

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2009150144-A1 NEW GPR119MODULATORS INOVACIA AB (SE) 2009-12-17 WO claimed
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
EP-2032657-A2 REVERSIBLY THERMOCHROMIC COMPOSITIONS Ciba Holding Inc. (CH) 2009-03-11 EP disclosed
WO-2007147847-A2 REVERSIBLY THERMOCHROMIC COMPOSITIONS CIBA HOLDING INC. (CH) 2007-12-27 WO disclosed