SCHEMBL29025262

SCHEMBL29025262

O=S(=O)(c1ccc(Nc2cc(Br)ccn2)cc1)N1CCCC1

nearest known ligand 0.54

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
MAPT P10636 6/20 0.49
KMT2A Q03164 4/20 0.49
ALDH1A1 P00352 4/20 0.49
MEN1 O00255 3/20 0.49
SMN1; SMN2 Q16637 2/20 0.49
HPGD P15428 1/20 0.49
RXFP1 Q9HBX9 1/20 0.49
USP2 O75604 2/20 0.47
KDM4C Q9H3R0 1/20 0.47
GAA P10253 1/20 0.47
KDM4E B2RXH2 1/20 0.47
PIP4K2A P48426 1/20 0.46
NPC1 O15118 2/20 0.46
RAB9A P51151 2/20 0.46
LMNA P02545 1/20 0.45
CCNE1 P24864 1/20 0.45
CDK2 P24941 1/20 0.45
FLT3 P36888 1/20 0.45

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
SCHEMBL29025242 0.89 TSHR (0.48) MAPTKMT2AALDH1A1MEN1SMN1; SMN2
SCHEMBL29025281 0.89 IKBKB (0.53)
SCHEMBL29025244 0.89 MEN1 (0.54) MAPTKMT2AALDH1A1MEN1SMN1; SMN2
SCHEMBL29025291 0.78 TNNI3K (0.49) PIP4K2ACCNE1CDK2
SCHEMBL29025274 0.76 IKBKB (0.48) KMT2AALDH1A1MEN1SMN1; SMN2USP2
SCHEMBL29025269 0.76 KMT2A (0.55) MAPTKMT2AALDH1A1MEN1GAA
SCHEMBL4170371 0.73 TGFBR1 (0.71) MAPTKMT2AALDH1A1MEN1SMN1; SMN2
SCHEMBL15953254 0.72 HTT (0.75) KMT2AALDH1A1MEN1SMN1; SMN2GAA
SCHEMBL2112295 0.72 USP2 (0.76) MAPTKMT2AALDH1A1MEN1SMN1; SMN2
SCHEMBL1518644 0.71 ALDH1A1 (0.48) MAPTKMT2AALDH1A1MEN1SMN1; SMN2

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-115160298-B Tacrine-sulfonamide derivative and preparation method and application thereof 中国人民解放军北部战区总医院 2023-05-23 CN disclosed