SCHEMBL7719944

SCHEMBL7719944

CN1CCN(S(=O)(=O)c2cccc(S(=O)(=O)Cl)c2)CC1

nearest known ligand 0.68

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
HTT P42858 3/20 0.68
MAPK1 P28482 1/20 0.68
LMNA P02545 1/20 0.68
POLB P06746 1/20 0.65
ATM Q13315 1/20 0.57
APOBEC3A P31941 1/20 0.56
APOBEC3G Q9HC16 1/20 0.56
L3MBTL1 Q9Y468 2/20 0.55
RAB9A P51151 1/20 0.55
SMN1; SMN2 Q16637 2/20 0.54
ALDH1A1 P00352 1/20 0.54
TSHR P16473 1/20 0.54
VCAM1 P19320 1/20 0.54
PKM P14618 1/20 0.54
MEN1 O00255 1/20 0.53
KMT2A Q03164 1/20 0.53
GAA P10253 1/20 0.52

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
SCHEMBL7719940 0.85 ALDH1A1 (0.56) HTTMAPK1LMNAPOLBL3MBTL1
SCHEMBL12674480 0.85 ALDH1A1 (0.74) HTTLMNAPOLBSMN1; SMN2ALDH1A1
SCHEMBL12674581 0.83 ALDH1A1 (0.72) HTTLMNAL3MBTL1SMN1; SMN2ALDH1A1
SCHEMBL14263406 0.82 POLB (0.67) HTTMAPK1LMNAPOLBATM
SCHEMBL21813105 0.81 POLB (0.61) HTTMAPK1LMNAPOLBAPOBEC3A
SCHEMBL15683000 0.81 POLB (0.65) HTTMAPK1LMNAPOLBATM
SCHEMBL6224554 0.81 PKM (0.67) HTTMAPK1LMNAPOLBATM
SCHEMBL266849 0.81 PKM (0.67) HTTMAPK1LMNAPOLBATM
SCHEMBL2379666 0.81 POLB (0.65) HTTMAPK1LMNAPOLBATM
SCHEMBL3936569 0.79 POLB (1.00) HTTLMNAPOLBATMAPOBEC3A

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