SCHEMBL29931995

SCHEMBL29931995

CN(C)S(=O)(=O)c1ccc(S(N)(=O)=O)c(-c2nn(C)cc2C2CCN(c3ccc(Cl)cc3F)CC2)c1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 5/20 0.38
GAA P10253 3/20 0.38
HTT P42858 2/20 0.38
TP53 P04637 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
POLB P06746 2/20 0.36
GPR55 Q9Y2T6 2/20 0.35
ALDH1A1 P00352 4/20 0.34
USP2 O75604 1/20 0.34
KMT2A Q03164 1/20 0.34
CNR1 P21554 1/20 0.33
THRB P10828 1/20 0.33
F10 P00742 4/20 0.33
ADORA2B P29275 1/20 0.33
KDM4E B2RXH2 3/20 0.32
MAPT P10636 2/20 0.32
HPGD P15428 2/20 0.32
DRD4 P21917 1/20 0.32
GRM2 Q14416 1/20 0.32
PRNP P04156 2/20 0.32

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
SCHEMBL29932118 0.85 GAA (0.38) LMNAGAAHTTTP53SMN1; SMN2
SCHEMBL29932225 0.85 GAA (0.40) LMNAGAAHTTTP53SMN1; SMN2
SCHEMBL29931997 0.84 GAA (0.38) LMNAGAAHTTTP53SMN1; SMN2
SCHEMBL29931920 0.83 GAA (0.37) LMNAGAAHTTTP53SMN1; SMN2
SCHEMBL29931771 0.81 GAA (0.35) LMNAGAAHTTTP53SMN1; SMN2
SCHEMBL29932150 0.81 LMNA (0.38) LMNAGAAHTTTP53SMN1; SMN2
SCHEMBL29932108 0.79 ALDH1A1 (0.43) LMNAGAAHTTTP53SMN1; SMN2
SCHEMBL30232726 0.78 LMNA (0.41) LMNAGAAHTTTP53SMN1; SMN2
SCHEMBL29931836 0.73 GAA (0.34) LMNAGAAHTTTP53SMN1; SMN2
SCHEMBL23536473 0.73 LMNA (0.30) LMNAGAAHTTTP53SMN1; 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-115087440-A TRPML modulators 卡斯玛治疗公司 2022-09-20 CN disclosed