SCHEMBL8905255

SCHEMBL8905255

CCC(=O)C(=O)N1c2ccccc2CCC1CO[Si](C)(C)C

nearest known ligand 0.45

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
MTNR1A P48039 10/20 0.45
MEN1 O00255 1/20 0.39
KMT2A Q03164 1/20 0.39
ACE P12821 1/20 0.38
POLB P06746 1/20 0.38
L3MBTL1 Q9Y468 1/20 0.38
PDK1 Q15118 1/20 0.37
PDK2 Q15119 1/20 0.37
PDK3 Q15120 1/20 0.37
PDK4 Q16654 1/20 0.37
TSHR P16473 1/20 0.37
MTNR1B P49286 1/20 0.37
PSEN1 P49768 1/20 0.37
PSEN2 P49810 1/20 0.37
APH1B Q8WW43 1/20 0.37
NCSTN Q92542 1/20 0.37
APH1A Q96BI3 1/20 0.37
PSENEN Q9NZ42 1/20 0.37

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
SCHEMBL8905262 0.86 MTNR1A (0.41) MTNR1AMEN1KMT2AACEL3MBTL1
SCHEMBL8905122 0.80 MTNR1A (0.44) MTNR1AMEN1KMT2AACEPOLB
SCHEMBL8904621 0.77 NOTUM (0.49) MTNR1AMEN1KMT2A
SCHEMBL7005115 0.74 ACE (0.41) MTNR1AMEN1KMT2AACEPDK1
SCHEMBL7007832 0.72 MTNR1A (0.38) MTNR1AMEN1KMT2AACE
SCHEMBL8905304 0.72 ALDH1A1 (0.51) MTNR1AMEN1KMT2AACEPOLB
SCHEMBL8355166 0.70 PSEN1 (0.63) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL8018491 0.69 MTNR1A (0.51) MTNR1AACEPOLBL3MBTL1PDK1
SCHEMBL11756352 0.69 MTNR1A (0.48) MTNR1AMEN1KMT2AACEPOLB
SCHEMBL8905128 0.68 ALDH1A1 (0.45) ACEPOLBL3MBTL1TSHR

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
US-5616586-A Tricyclic quinoxalinediones SUMITOMO PHARMACEUTICALS COMPANY, LIMITED (JP) 1997-04-01 US disclosed
WO-1993008188-A1 TRICYCLIC QUINOXALINEDIONES AS GLUTAMATE RECEPTOR ANTAGONISTS SUMITOMO PHARMACEUTICALS COMPANY, LIMITED (JP) 1993-04-29 WO disclosed