SCHEMBL29279869

SCHEMBL29279869

Fc1cc(Br)ccc1-c1ccccc1S

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTPRC P08575 2/20 0.46
NMUR2 Q9GZQ4 1/20 0.40
ALOX5AP P20292 1/20 0.39
FEN1 P39748 1/20 0.39
PDK2 Q15119 1/20 0.38
GABRP O00591 1/20 0.36
GABRD O14764 1/20 0.36
GABRA1 P14867 1/20 0.36
GABRB1 P18505 1/20 0.36
GABRG2 P18507 1/20 0.36
GABRB3 P28472 1/20 0.36
GABRA5 P31644 1/20 0.36
GABRA3 P34903 1/20 0.36
GABRA2 P47869 1/20 0.36
GABRB2 P47870 1/20 0.36
GABRA4 P48169 1/20 0.36
GABRE P78334 1/20 0.36
GABRA6 Q16445 1/20 0.36
GABRG1 Q8N1C3 1/20 0.36
GABRG3 Q99928 1/20 0.36

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
SCHEMBL29290422 0.85 GABRA1 (0.42) PTPRCNMUR2PDK2GABRPGABRD
SCHEMBL29290421 0.85 PTPRC (0.46) PTPRCNMUR2PDK2GABRPGABRD
SCHEMBL11728016 0.84 PTPRC (0.47) PTPRCNMUR2ALOX5APFEN1PDK2
SCHEMBL14520998 0.81 DGAT1 (0.46) PTPRCNMUR2ALOX5APFEN1DGAT1
SCHEMBL31310573 0.81 DGAT1 (0.46) PTPRCNMUR2ALOX5APFEN1DGAT1
SCHEMBL29279873 0.81 SMN1; SMN2 (0.43) PTPRCNMUR2PDK2GABRPGABRD
SCHEMBL1357074 0.77 HPGD (0.47) PTPRCNMUR2ALOX5APFEN1PDK2
SCHEMBL19180559 0.77 PTPRC (0.46) PTPRCPDK2SMN1; SMN2NPC1LMNA
SCHEMBL28580381 0.77 PTPRC (0.46) PTPRCPDK2NPC1ALDH1A1CYP2A6
SCHEMBL28837915 0.77 PTPRC (0.46) PTPRCPDK2SMN1; SMN2NPC1LMNA

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-117682973-A Sulfonamide compound and medical application thereof 中国药科大学 2024-03-12 CN disclosed