SCHEMBL30883100

SCHEMBL30883100

CCOC(=O)c1cc2nc(Cl)ccc2n1S(=O)(=O)Cc1ccccc1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NOD2 Q9HC29 5/20 0.47
NOD1 Q9Y239 5/20 0.47
SMN1; SMN2 Q16637 2/20 0.45
POLB P06746 2/20 0.45
TDP1 Q9NUW8 2/20 0.43
TSHR P16473 3/20 0.42
GAA P10253 2/20 0.42
CYP2C19 P33261 1/20 0.42
MAPT P10636 4/20 0.41
ALDH1A1 P00352 2/20 0.41
ATM Q13315 1/20 0.41
PKM P14618 2/20 0.40
NPSR1 Q6W5P4 1/20 0.40
LMNA P02545 2/20 0.40
MEN1 O00255 1/20 0.39
KMT2A Q03164 1/20 0.39
SIRT2 Q8IXJ6 1/20 0.39
SIRT1 Q96EB6 1/20 0.39
MAPK1 P28482 1/20 0.39
KDM4E B2RXH2 1/20 0.39

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
SCHEMBL7214149 0.85 NOD2 (0.62) NOD2NOD1SMN1; SMN2POLBTSHR
SCHEMBL26620160 0.79 NOD1 (0.64) NOD2NOD1TSHRGAAMAPT
SCHEMBL30883111 0.77 SRC (0.39) TSHRGAACYP2C19LMNAMEN1
SCHEMBL30883114 0.74 LMNA (0.38) TDP1TSHRGAACYP2C19NPSR1
SCHEMBL16254657 0.73 NOD1 (0.46) NOD2NOD1POLBTSHRMAPT
SCHEMBL16852961 0.72 SMN1; SMN2 (0.39) NOD2NOD1SMN1; SMN2TDP1MAPT
SCHEMBL29189067 0.72 NOD2 (0.46) NOD2NOD1SMN1; SMN2POLBTDP1
SCHEMBL30436082 0.72 NOD2 (0.46) NOD2NOD1SMN1; SMN2POLBTDP1
SCHEMBL16818422 0.71 F10 (0.48) NOD2NOD1POLBTDP1TSHR
SCHEMBL16818895 0.70 NOD1 (0.43) NOD2NOD1TSHRMAPTALDH1A1

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-117916241-A Spiro compounds 阿斯利康(瑞典)有限公司 2024-04-19 CN disclosed