SCHEMBL7719940

SCHEMBL7719940

[CH2]N1CCN(S(=O)(=O)c2cccc(S(=O)(=O)Cl)c2)CC1

nearest known ligand 0.59

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.56
SMN1; SMN2 Q16637 2/20 0.56
KMT2A Q03164 2/20 0.53
MEN1 O00255 1/20 0.53
LMNA P02545 5/20 0.51
TSHR P16473 3/20 0.51
THRB P10828 1/20 0.51
NPSR1 Q6W5P4 1/20 0.51
HTT P42858 3/20 0.50
MAPK1 P28482 1/20 0.50
KDM4E B2RXH2 1/20 0.46
PKM P14618 2/20 0.46
PKLR P30613 1/20 0.46
MAPT P10636 1/20 0.45
IL1RN P18510 1/20 0.45
POLB P06746 1/20 0.45
USP2 O75604 1/20 0.45
L3MBTL1 Q9Y468 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
SCHEMBL12674480 0.86 ALDH1A1 (0.74) ALDH1A1SMN1; SMN2KMT2AMEN1LMNA
SCHEMBL7719944 0.85 HTT (0.68) ALDH1A1SMN1; SMN2KMT2AMEN1LMNA
SCHEMBL12674581 0.85 ALDH1A1 (0.72) ALDH1A1SMN1; SMN2KMT2AMEN1LMNA
SCHEMBL24762195 0.80 LMNA (0.50) ALDH1A1SMN1; SMN2KMT2AMEN1LMNA
SCHEMBL29764391 0.80 LMNA (0.50) ALDH1A1SMN1; SMN2KMT2AMEN1LMNA
SCHEMBL4526586 0.78 POLB (0.69) ALDH1A1SMN1; SMN2LMNATSHRPKM
SCHEMBL56599 0.75 ALDH1A1 (0.65) ALDH1A1SMN1; SMN2KMT2AMEN1LMNA
SCHEMBL10726996 0.75 ALDH1A1 (0.86) ALDH1A1SMN1; SMN2KMT2AMEN1LMNA
SCHEMBL31315849 0.72 PKM (0.70) ALDH1A1SMN1; SMN2KMT2AMEN1LMNA
SCHEMBL10860773 0.72 PKM (0.77) ALDH1A1SMN1; SMN2KMT2AMEN1LMNA

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
US-6388022-B1 POLYSTYRENE TAKEDA CHEMICAL INDUSTIRES, LTD. (JP) 2002-05-14 US disclosed
EP-0985662-A2 Linker binding carriers for organic synthesis, their production and use Takeda Chemical Industries, Ltd. (JP) 2000-03-15 EP disclosed