SCHEMBL30454034

SCHEMBL30454034

O=C1NCCc2ccc(-c3ccc(Cl)cc3F)cc21

nearest known ligand 0.68

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PARP10 Q53GL7 13/20 0.68
PARP1 P09874 6/20 0.68
F7 P08709 1/20 0.68
F3 P13726 1/20 0.68
PARP11 Q9NR21 8/20 0.54
JAK2 O60674 1/20 0.50
NTRK1 P04629 1/20 0.50
MET P08581 1/20 0.50
FGFR1 P11362 1/20 0.50
PRKACA P17612 1/20 0.50
KDR P35968 1/20 0.50
MAP2K2 P36507 1/20 0.50
FLT3 P36888 1/20 0.50
GSK3B P49841 1/20 0.50
MAP2K1 Q02750 1/20 0.50
MST1R Q04912 1/20 0.50
NTRK3 Q16288 1/20 0.50
NTRK2 Q16620 1/20 0.50
CAMK1D Q8IU85 1/20 0.50
CD274 Q9NZQ7 1/20 0.45

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
SCHEMBL22391640 1.00 PARP10 (0.68) PARP10PARP1F7F3PARP11
SCHEMBL793493 0.82 PARP10 (1.00) PARP10PARP1F7F3PARP11
SCHEMBL29676942 0.82 PARP10 (1.00) PARP10PARP1F7F3PARP11
SCHEMBL797294 0.77 PARP10 (0.76) PARP10PARP1F7F3PARP11
SCHEMBL8151102 0.76 PARP10 (0.70) PARP10PARP1PARP11NTRK1FLT3
SCHEMBL1315035 0.76 PARP10 (0.74) PARP10PARP1F7F3PARP11
SCHEMBL19088736 0.75 ASIC3 (0.60) CD274
SCHEMBL18112980 0.74 MAPK1 (0.56) PARP10PARP1F7F3PARP11
SCHEMBL8155836 0.74 PARP10 (0.76) PARP10PARP1F7F3PARP11
SCHEMBL8155829 0.73 PARP11 (0.68) PARP10PARP1PARP11METKDR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-113227068-B GLP-1R agonists and uses thereof 上海齐鲁锐格医药研发有限公司 2023-06-13 CN disclosed