SCHEMBL31487952

SCHEMBL31487952

COC(=O)c1cc(Br)c(Cl)cc1Cl

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.47
NPSR1 Q6W5P4 2/20 0.47
GAA P10253 2/20 0.45
ABL1 P00519 1/20 0.43
MEN1 O00255 4/20 0.43
KMT2A Q03164 4/20 0.43
LMNA P02545 3/20 0.43
SOS1 Q07889 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
ALDH1A1 P00352 2/20 0.41
HTT P42858 2/20 0.41
NQO2 P16083 1/20 0.41
TSHR P16473 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.40
CA12 O43570 4/20 0.39
CA1 P00915 4/20 0.39
CA2 P00918 4/20 0.39
CA9 Q16790 4/20 0.39
CA7 P43166 2/20 0.39
CA14 Q9ULX7 2/20 0.39

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
SCHEMBL17118715 1.00 MAPT (0.47) MAPTNPSR1GAAABL1MEN1
SCHEMBL8378560 0.89 GAA (0.49) MAPTNPSR1GAAABL1MEN1
SCHEMBL71501 0.86 GAA (0.52) MAPTNPSR1GAAABL1MEN1
SCHEMBL20045541 0.85 GAA (0.42) MAPTNPSR1GAAABL1MEN1
SCHEMBL747498 0.85 CA1 (0.49) MAPTNPSR1GAAABL1MEN1
SCHEMBL17239465 0.85 ABL1 (0.45) MAPTNPSR1GAAABL1MEN1
SCHEMBL17249571 0.85 MAPT (0.45) MAPTNPSR1GAAABL1MEN1
SCHEMBL31301254 0.85 GAA (0.49) GAAABL1MEN1KMT2ALMNA
SCHEMBL24801432 0.84 GAA (0.45) MAPTNPSR1GAAABL1MEN1
SCHEMBL18981860 0.84 GAA (0.49) MAPTNPSR1GAAABL1MEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-119462555-A Sulfonamide compound and application thereof 上海科技大学 2025-02-18 CN disclosed
WO-2025031360-A1 SULFONAMIDE COMPOUND AND USE THEREOF 上海科技大学 2025-02-13 WO disclosed