SCHEMBL8905262

SCHEMBL8905262

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

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MTNR1A P48039 5/20 0.41
ALDH1A1 P00352 1/20 0.39
NOTUM Q6P988 1/20 0.39
L3MBTL1 Q9Y468 1/20 0.39
NPSR1 Q6W5P4 1/20 0.39
PKM P14618 1/20 0.38
MEN1 O00255 1/20 0.38
KMT2A Q03164 1/20 0.38
GAA P10253 2/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
ACE P12821 4/20 0.38
PSEN1 P49768 1/20 0.38
PSEN2 P49810 1/20 0.38
APH1B Q8WW43 1/20 0.38
NCSTN Q92542 1/20 0.38
APH1A Q96BI3 1/20 0.38
PSENEN Q9NZ42 1/20 0.38
ABCB11 O95342 1/20 0.38
AGTR2 P50052 1/20 0.38
PDE3A Q14432 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
SCHEMBL8905255 0.86 MTNR1A (0.45) MTNR1AL3MBTL1MEN1KMT2AACE
SCHEMBL8905128 0.82 ALDH1A1 (0.45) ALDH1A1NOTUML3MBTL1NPSR1PKM
SCHEMBL8904624 0.81 NOTUM (0.50) MTNR1AALDH1A1NOTUML3MBTL1NPSR1
SCHEMBL8905306 0.76 ALDH1A1 (0.52) ALDH1A1NOTUML3MBTL1NPSR1PKM
SCHEMBL11756352 0.74 MTNR1A (0.48) MTNR1AALDH1A1NOTUML3MBTL1MEN1
SCHEMBL7005115 0.73 ACE (0.41) MTNR1AMEN1KMT2AACE
SCHEMBL8904621 0.71 NOTUM (0.49) MTNR1AALDH1A1NOTUMMEN1KMT2A
SCHEMBL7831498 0.71 POLB (0.56) ALDH1A1NOTUML3MBTL1MEN1KMT2A
SCHEMBL7007832 0.70 MTNR1A (0.38) MTNR1AMEN1KMT2ASMN1; SMN2ACE
SCHEMBL8905266 0.70 L3MBTL1 (0.32) L3MBTL1GAA

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