SCHEMBL5579263

SCHEMBL5579263

CCOC(=O)Oc1ccc2c(c1)CSO2

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 6/20 0.45
CA2 P00918 1/20 0.44
MMP8 P22894 3/20 0.43
MMP2 P08253 2/20 0.43
MMP9 P14780 2/20 0.43
MMP14 P50281 2/20 0.43
MEN1 O00255 3/20 0.40
POLB P06746 1/20 0.40
L3MBTL1 Q9Y468 1/20 0.40
KDM4E B2RXH2 4/20 0.39
MAPT P10636 2/20 0.39
LMNA P02545 1/20 0.39
MMP3 P08254 1/20 0.38
CRHBP P24387 1/20 0.37
CRHR2 Q13324 1/20 0.37
ALDH1A1 P00352 4/20 0.37
SMN1; SMN2 Q16637 2/20 0.37
TYMS P04818 1/20 0.36
GAA P10253 2/20 0.36
HPGD P15428 1/20 0.36

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
SCHEMBL5579264 0.73 KMT2A (0.45) KMT2ACA2MMP8MMP2MMP9
SCHEMBL6891449 0.73 POLB (0.50) KMT2ACA2MMP8MMP2MMP9
SCHEMBL6451238 0.72 ALDH1A1 (0.55) KMT2ACA2MMP8MMP2MMP9
SCHEMBL8421941 0.70 KMT2A (0.56) KMT2ACA2MEN1POLBL3MBTL1
SCHEMBL15547058 0.69 BRD4 (0.50) KMT2ACA2MMP8MMP2MMP9
SCHEMBL10344222 0.69 KMT2A (0.51) KMT2ACA2MEN1POLBL3MBTL1
SCHEMBL7303827 0.68 MTNR1A (0.45) KMT2ACA2MMP8MMP2MMP9
SCHEMBL10344224 0.67 KMT2A (0.54) KMT2ACA2MMP8MMP2MMP9
SCHEMBL18272440 0.67 KMT2A (0.50) KMT2ACA2MMP8MMP2MMP9
SCHEMBL1598705 0.67 LMNA (0.57) KMT2ACA2MMP8MMP2MMP9

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
US-20070148185-A1 Novel therapeutic target for protozoal diseases VIRGINIA POLYTECHNIC INSTITUTE AND STATE UNIVERSITY 2007-06-28 US disclosed