SCHEMBL31135583

SCHEMBL31135583

COCCn1c(=O)c2ccccc2n(CCN2CCCCC2)c1=O

nearest known ligand 0.54

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 3/20 0.54
TSHR P16473 1/20 0.54
KMT2A Q03164 4/20 0.48
MEN1 O00255 3/20 0.48
MAPT P10636 2/20 0.48
MPO P05164 1/20 0.47
ADORA2B P29275 2/20 0.47
ALDH1A1 P00352 4/20 0.45
LMNA P02545 1/20 0.44
CYP2D6 P10635 1/20 0.44
ADRA2A P08913 1/20 0.43
ADRA2B P18089 1/20 0.43
ADRA2C P18825 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
NPSR1 Q6W5P4 1/20 0.43

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
SCHEMBL30478144 0.84 PARG (0.46) KDM4ETSHRADORA2BALDH1A1
SCHEMBL25422664 0.84 PARG (0.46) KDM4ETSHRADORA2BALDH1A1
SCHEMBL25439300 0.82 PARG (0.46) KDM4ETSHRKMT2AMEN1MAPT
SCHEMBL25424268 0.80 PARG (0.47) KDM4ETSHRKMT2AMEN1ALDH1A1
SCHEMBL25725101 0.80 MAPT (0.49) KDM4ETSHRKMT2AMEN1MAPT
SCHEMBL25422095 0.79 PARG (0.48) KMT2AMEN1ALDH1A1LMNACYP2D6
SCHEMBL31135590 0.78 PARG (0.43) KDM4ETSHRMAPTALDH1A1
SCHEMBL22716908 0.78 MPO (0.46) KDM4EKMT2AMAPTMPOALDH1A1
SCHEMBL31189225 0.78 MPO (0.46) KDM4EKMT2AMAPTMPOALDH1A1
SCHEMBL25724418 0.78 PARG (0.46) KDM4ETSHRKMT2AMEN1ADORA2B

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
CN-118451062-A Preparation and use of quinazolinediones 科学与工业研究会(按照印度社会团体注册法案(1860年第21号法案)设立的注册机构) 2024-08-06 CN claimed
CN-118451062-A Preparation and use of quinazolinediones 科学与工业研究会(按照印度社会团体注册法案(1860年第21号法案)设立的注册机构) 2024-08-06 CN disclosed