SCHEMBL25937664

SCHEMBL25937664

NCC(=O)N1CCSc2ccccc21

nearest known ligand 0.65

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
NOTUM Q6P988 1/20 0.65
KDM4E B2RXH2 1/20 0.61
DRD4 P21917 1/20 0.56
L3MBTL1 Q9Y468 2/20 0.56
LMNA P02545 1/20 0.56
HPGD P15428 1/20 0.56
GAA P10253 1/20 0.56
SMN1; SMN2 Q16637 1/20 0.56
POLB P06746 3/20 0.55
MAPT P10636 2/20 0.55
TP53 P04637 1/20 0.55

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
SCHEMBL19888977 0.84 NOTUM (0.65) NOTUMKDM4EDRD4L3MBTL1LMNA
SCHEMBL6224256 0.82 NOTUM (0.71) NOTUMKDM4EDRD4L3MBTL1LMNA
Hydrochloric Acid SCHEMBL27871154 0.81 NOTUM (0.69) NOTUMKDM4EDRD4L3MBTL1LMNA
SCHEMBL10664492 0.81 DRD4 (0.57) NOTUMKDM4EDRD4L3MBTL1LMNA
SCHEMBL15524285 0.80 NOTUM (0.73) NOTUMKDM4EDRD4L3MBTL1LMNA
SCHEMBL7413168 0.77 DRD4 (0.59) NOTUMKDM4EDRD4L3MBTL1LMNA
SCHEMBL16907792 0.76 DRD4 (0.67) NOTUMKDM4EDRD4L3MBTL1LMNA
SCHEMBL29876158 0.76 DRD4 (0.61) NOTUMKDM4EDRD4L3MBTL1LMNA
SCHEMBL16907790 0.76 DRD4 (0.66) NOTUMKDM4EDRD4L3MBTL1POLB
SCHEMBL10636595 0.75 NOTUM (0.65) NOTUMKDM4EDRD4L3MBTL1LMNA

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
WO-2023144793-A1 POL THETA INHIBITORS RHIZEN PHARMACEUTICALS AG (CH) 2023-08-03 WO disclosed