SCHEMBL2552279

SCHEMBL2552279

COCCc1nccc(N)c1N

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
IKBKB O14920 1/20 0.37
TDP1 Q9NUW8 2/20 0.34
GAA P10253 1/20 0.34
MAPT P10636 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
NOS2 P35228 3/20 0.32
NOS3 P29474 2/20 0.32
NOS1 P29475 1/20 0.32
TLR7 Q9NYK1 1/20 0.32
GRM4 Q14833 1/20 0.31
TSHR P16473 1/20 0.31
HCAR3 P49019 1/20 0.30
ALDH1A1 P00352 1/20 0.30
LMNA P02545 1/20 0.30
LOXL2 Q9Y4K0 2/20 0.30
CCNT1 O60563 1/20 0.30
CDK9 P50750 1/20 0.30
CDK5 Q00535 1/20 0.30
CDK5R1 Q15078 1/20 0.30
LOX P28300 1/20 0.30

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
SCHEMBL30676086 1.00 IKBKB (0.37) IKBKBTDP1GAAMAPTSMN1; SMN2
SCHEMBL7023474 0.79 NOS2 (0.44) NOS2NOS3NOS1TSHRALDH1A1
SCHEMBL8560653 0.76 MEN1 (0.37) TDP1MAPTSMN1; SMN2ALDH1A1LMNA
SCHEMBL28135777 0.75 HCAR2 (0.36) SMN1; SMN2TLR7TSHRHCAR3ALDH1A1
SCHEMBL28076490 0.75 TLR7 (0.41) IKBKBTDP1GAASMN1; SMN2NOS2
SCHEMBL28043957 0.74 NOS2 (0.44) IKBKBTDP1MAPTNOS2NOS3
SCHEMBL3064440 0.74 NOS2 (0.42) TDP1GAAMAPTSMN1; SMN2NOS2
SCHEMBL15923846 0.73 TSHR (0.38) TDP1GAAMAPTSMN1; SMN2NOS1
SCHEMBL17335193 0.73 CYP2C9 (0.38) SMN1; SMN2NOS1TSHRALDH1A1LMNA
SCHEMBL6031561 0.70 NOS2 (0.44) IKBKBNOS2NOS3NOS1TLR7

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-112566637-B GLP-1 receptor agonists and uses thereof 辉瑞公司 2023-11-14 CN disclosed
CN-112566637-A GLP-1 receptor agonists and uses thereof 辉瑞公司 2021-03-26 CN disclosed
EP-2552208-A1 IMIDAZOLYL-IMIDAZOLES AS KINASE INHIBITORS Glaxo Group Limited (GB) 2013-02-06 EP disclosed
WO-2011123609-A1 IMIDAZOLYL-IMIDAZOLES AS KINASE INHIBITORS GLAXO GROUP LIMITED (GB) 2011-10-06 WO disclosed