SCHEMBL28232247

SCHEMBL28232247

O=C(CO)NS(=O)(=O)Oc1ccccc1

nearest known ligand 0.64

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 3/20 0.64
MEN1 O00255 2/20 0.64
CA1 P00915 5/20 0.42
CA2 P00918 5/20 0.42
CA9 Q16790 5/20 0.42
TP53 P04637 1/20 0.41
CA12 O43570 3/20 0.39
MMP1 P03956 2/20 0.38
MMP13 P45452 2/20 0.38
ADAMTS4 O75173 1/20 0.38
MMP2 P08253 1/20 0.38
MMP14 P50281 1/20 0.38
MEP1B Q16820 1/20 0.38
ADAMTS5 Q9UNA0 1/20 0.38
MMP8 P22894 1/20 0.38
MMP12 P39900 1/20 0.38
ALPL P05186 1/20 0.38
ALPI P09923 1/20 0.38
ALPG P10696 1/20 0.38
STS P08842 1/20 0.38

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
SCHEMBL7532809 0.84 KMT2A (0.62) KMT2AMEN1CA1CA2CA9
SCHEMBL2640221 0.81 MEN1 (0.58) KMT2AMEN1TP53STSMAPT
SCHEMBL27538963 0.81 KMT2A (0.58) KMT2AMEN1CA1CA2CA9
SCHEMBL7111521 0.81 KMT2A (0.72) KMT2AMEN1CA1CA2CA9
SCHEMBL15424553 0.78 MEN1 (0.68) KMT2AMEN1CA1CA2CA9
SCHEMBL728970 0.78 KMT2A (1.00) KMT2AMEN1CA1CA2CA9
SCHEMBL27029813 0.76 MEN1 (0.66) KMT2AMEN1CA1CA2CA9
SCHEMBL27397738 0.75 MEN1 (0.64) KMT2AMEN1CA1CA2CA9
SCHEMBL9451255 0.75 MEN1 (0.58) KMT2AMEN1CA1CA2CA9
SCHEMBL15423450 0.74 KMT2A (0.62) KMT2AMEN1CA1CA2CA9

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-108369612-A Automated sample quality assessment 梅塔博隆股份有限公司 2018-08-03 CN disclosed