SCHEMBL8905128

SCHEMBL8905128

CCOC(=O)C(=O)N1c2ccccc2CCC1C=O

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.45
L3MBTL1 Q9Y468 2/20 0.43
NOTUM Q6P988 1/20 0.43
NPSR1 Q6W5P4 3/20 0.42
PKM P14618 1/20 0.42
LMNA P02545 2/20 0.42
CYP1A2 P05177 2/20 0.42
CYP2C19 P33261 2/20 0.42
CYP3A4 P08684 1/20 0.42
TSHR P16473 1/20 0.42
HTT P42858 1/20 0.42
SMN1; SMN2 Q16637 2/20 0.41
GAA P10253 1/20 0.41
ACE P12821 1/20 0.40
POLB P06746 1/20 0.40
MAPT P10636 1/20 0.40
CYP2D6 P10635 1/20 0.40
CYP2C9 P11712 1/20 0.40
NPC1 O15118 1/20 0.39
RAB9A P51151 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
SCHEMBL8905306 0.87 ALDH1A1 (0.52) ALDH1A1L3MBTL1NOTUMNPSR1PKM
SCHEMBL8905122 0.83 MTNR1A (0.44) L3MBTL1TSHRACEPOLB
SCHEMBL8905262 0.82 MTNR1A (0.41) ALDH1A1L3MBTL1NOTUMNPSR1PKM
SCHEMBL8904624 0.79 NOTUM (0.50) ALDH1A1L3MBTL1NOTUMNPSR1PKM
SCHEMBL8905304 0.77 ALDH1A1 (0.51) ALDH1A1L3MBTL1NOTUMNPSR1LMNA
SCHEMBL7831498 0.75 POLB (0.56) ALDH1A1L3MBTL1NOTUMLMNATSHR
SCHEMBL6195732 0.74 POLB (0.57) TSHRSMN1; SMN2ACEPOLBNPC1
SCHEMBL11756352 0.74 MTNR1A (0.48) ALDH1A1L3MBTL1NOTUMLMNASMN1; SMN2
SCHEMBL8904589 0.73 ALDH1A1 (0.65) ALDH1A1L3MBTL1NOTUMNPSR1LMNA
SCHEMBL5740568 0.73 SMN1; SMN2 (0.49) ALDH1A1L3MBTL1NOTUMLMNACYP3A4

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 3 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
EP-0642508-A1 TRICYCLIC QUINOXALINEDIONES AS GLUTAMATE RECEPTOR ANTAGONISTS SUMITOMO PHARMACEUTICALS COMPANY, LIMITED (JP) 1995-03-15 EP disclosed
WO-1993008188-A1 TRICYCLIC QUINOXALINEDIONES AS GLUTAMATE RECEPTOR ANTAGONISTS SUMITOMO PHARMACEUTICALS COMPANY, LIMITED (JP) 1993-04-29 WO disclosed