SCHEMBL24681279

SCHEMBL24681279

CN(C1CCN(c2ccc(Br)c(F)c2F)C1)S(C)(=O)=O

nearest known ligand 0.38

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ PDE10A Q9Y233 1/20 0.38
▸ PIK3CD O00329 5/20 0.37
▸ PIK3R1 P27986 5/20 0.37
▸ PIK3CA P42336 5/20 0.37
▸ PIK3CB P42338 3/20 0.37
▸ JAK2 O60674 4/20 0.36
▸ JAK3 P52333 2/20 0.36
▸ HTR2A P28223 1/20 0.35
▸ HTR2C P28335 1/20 0.35
▸ NPY5R Q15761 3/20 0.34
▸ JAK1 P23458 1/20 0.34
▸ HSD11B1 P28845 1/20 0.34
▸ DDR1 Q08345 1/20 0.33
▸ BTK Q06187 1/20 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
SCHEMBL24680787 1.00 PDE10A (0.38) PDE10APIK3CDPIK3R1PIK3CAPIK3CB
SCHEMBL29914526 1.00 PDE10A (0.38) PDE10APIK3CDPIK3R1PIK3CAPIK3CB
SCHEMBL29914530 1.00 PDE10A (0.38) PDE10APIK3CDPIK3R1PIK3CAPIK3CB
SCHEMBL29914606 0.84 PIM1 (0.39) BTK
SCHEMBL24681116 0.84 PIM1 (0.39) BTK
SCHEMBL24681006 0.81 NPY5R (0.43) PDE10APIK3CDPIK3R1PIK3CAPIK3CB
SCHEMBL29914608 0.81 NPY5R (0.43) PDE10APIK3CDPIK3R1PIK3CAPIK3CB
SCHEMBL24681623 0.81 NPY5R (0.43) PDE10APIK3CDPIK3R1PIK3CAPIK3CB
SCHEMBL29914569 0.81 NPY5R (0.43) PDE10APIK3CDPIK3R1PIK3CAPIK3CB
SCHEMBL25966654 0.81 HTR2A (0.41) PIK3CDPIK3R1PIK3CAHTR2AHTR2C

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-2022226667-A1 SUBSTITUTED AMINO PYRIDINE COMPOUNDS AS INHIBITORS OF THE HAEMATOPOIETIC PROGENITOR KINASE 1 (HPK1) ONTARIO INSTITUTE FOR CANCER RESEARCH (OICR) (CA) 2022-11-03 — — WO disclosed
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