SCHEMBL28528495

SCHEMBL28528495

COCOCCOc1cccc(F)c1Br

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 8/20 0.41
TDP1 Q9NUW8 3/20 0.41
MAPT P10636 6/20 0.38
GRM2 Q14416 1/20 0.37
KDM4E B2RXH2 5/20 0.36
LMNA P02545 4/20 0.35
HTT P42858 1/20 0.35
CYP1A2 P05177 2/20 0.35
CYP2C19 P33261 2/20 0.35
MAPK1 P28482 2/20 0.35
CYP3A4 P08684 1/20 0.35
CYP2C9 P11712 1/20 0.35
SMN1; SMN2 Q16637 2/20 0.34
ALDH1A1 P00352 1/20 0.34
CYP2D6 P10635 1/20 0.34
RAB9A P51151 1/20 0.34
KCNN4 O15554 1/20 0.33
MEN1 O00255 1/20 0.33
KMT2A Q03164 1/20 0.33
NCF1 P14598 3/20 0.33

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
SCHEMBL28515302 0.87 L3MBTL1 (0.46) L3MBTL1TDP1MAPTGRM2KDM4E
SCHEMBL6004407 0.85 KCNN4 (0.40) L3MBTL1TDP1GRM2KDM4ECYP2C19
SCHEMBL28520016 0.78 GABRA1 (0.34) L3MBTL1TDP1
SCHEMBL16179018 0.76 L3MBTL1 (0.41) L3MBTL1TDP1GRM2KDM4ECYP1A2
SCHEMBL31394250 0.76 L3MBTL1 (0.41) L3MBTL1TDP1GRM2KDM4ECYP1A2
SCHEMBL29233757 0.76 ALOX5AP (0.39) L3MBTL1TDP1GRM2MAPK1SMN1; SMN2
SCHEMBL25235421 0.75 L3MBTL1 (0.43) L3MBTL1TDP1GRM2KDM4ECYP1A2
SCHEMBL4522678 0.75 GRM2 (0.40) L3MBTL1TDP1MAPTGRM2KDM4E
SCHEMBL4535910 0.74 L3MBTL1 (0.55) L3MBTL1TDP1MAPTKDM4ELMNA
SCHEMBL29234122 0.73 GRM2 (0.42) L3MBTL1TDP1GRM2KDM4ECYP1A2

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-112159405-B Pyridopyrimidinone compounds and application thereof 广州必贝特医药技术有限公司 2021-09-14 CN disclosed
CN-112159405-A Pyridopyrimidinone compounds and application thereof 广州必贝特医药技术有限公司 2021-01-01 CN disclosed