SCHEMBL29651295

SCHEMBL29651295

O=S(=O)(Cl)c1cn(S(=O)(=O)c2ccccc2)c2ccccc12

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTR6 P50406 13/20 0.60
LMNA P02545 1/20 0.56
SMN1; SMN2 Q16637 1/20 0.56
PLK1 P53350 1/20 0.52
CA12 O43570 1/20 0.52
CA1 P00915 1/20 0.52
CA2 P00918 1/20 0.52
CA9 Q16790 1/20 0.52
MEN1 O00255 1/20 0.52
KMT2A Q03164 1/20 0.52
HTR1A P08908 1/20 0.51
DRD2 P14416 1/20 0.51
HTR1D P28221 1/20 0.51
HTR1B P28222 1/20 0.51
HTR1F P30939 1/20 0.51
HTR7 P34969 1/20 0.51
DRD3 P35462 1/20 0.51
CYP3A4 P08684 1/20 0.51
CYP2D6 P10635 1/20 0.51
L3MBTL1 Q9Y468 1/20 0.50

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
SCHEMBL22864566 1.00 HTR6 (0.60) HTR6LMNASMN1; SMN2PLK1CA12
SCHEMBL27152273 0.88 KDM4E (0.64) HTR6LMNASMN1; SMN2CA2CA9
SCHEMBL29651324 0.84 CA12 (0.63) HTR6LMNASMN1; SMN2PLK1CA12
SCHEMBL22864562 0.84 CA12 (0.63) HTR6LMNASMN1; SMN2PLK1CA12
SCHEMBL14207893 0.84 HTR6 (0.60) HTR6LMNASMN1; SMN2PLK1CA12
SCHEMBL29365123 0.84 HTR6 (0.55) HTR6LMNASMN1; SMN2HTR1ACYP3A4
SCHEMBL20354867 0.84 HTR6 (0.55) HTR6LMNASMN1; SMN2HTR1ACYP3A4
SCHEMBL29365118 0.84 HTR6 (0.55) HTR6LMNASMN1; SMN2HTR1ACYP3A4
SCHEMBL30991290 0.83 L3MBTL1 (0.47) HTR6LMNASMN1; SMN2PLK1MEN1
SCHEMBL21596675 0.83 L3MBTL1 (0.47) HTR6LMNASMN1; SMN2PLK1MEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-114555585-B HPK1 inhibitors and uses thereof 锐格药业公司 2025-02-11 CN disclosed
CN-114555585-A HPK1 inhibitors and uses thereof 上海齐鲁锐格医药研发有限公司 2022-05-27 CN disclosed
EP-3994133-A1 HPK1 INHIBITORS AND USES THEREOF Qilu Regor Therapeutics Inc. (CN) 2022-05-11 EP disclosed