SCHEMBL7330474

SCHEMBL7330474

COCCC1=NC(=O)C(Oc2ccccc2OC)C(=O)N1

nearest known ligand 0.33

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.33
KDM4E B2RXH2 1/20 0.33
PDE2A O00408 1/20 0.33
CA12 O43570 1/20 0.33
CA1 P00915 1/20 0.33
CA2 P00918 1/20 0.33
CA4 P22748 1/20 0.33
CA7 P43166 1/20 0.33
CA9 Q16790 1/20 0.33
CA14 Q9ULX7 1/20 0.33
ALDH1A1 P00352 3/20 0.32
USP2 O75604 2/20 0.32
HSD17B10 Q99714 2/20 0.32
GAA P10253 1/20 0.32
CHEK1 O14757 1/20 0.32
PDE4A P27815 5/20 0.32
PDE4B Q07343 5/20 0.32
PDE4C Q08493 5/20 0.32
PDE4D Q08499 5/20 0.32
LMNA P02545 2/20 0.31

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
SCHEMBL7293888 0.86 CA12 (0.35) MAPTKDM4EPDE2ACA12CA1
SCHEMBL7303598 0.75 CA12 (0.35) MAPTKDM4ECA12CA1CA2
SCHEMBL7296783 0.74 DDB1 (0.37) CA12CA1CA2CA4CA7
SCHEMBL627191 0.74 RAB9A (0.35) KDM4ECA12CA1CA2CA4
SCHEMBL7209808 0.72 CA2 (0.46) MAPTKDM4ECA12CA1CA2
SCHEMBL7303932 0.71 ALDH1A1 (0.40) MAPTKDM4EALDH1A1HSD17B10GAA
SCHEMBL7297774 0.70 FYN (0.39) MAPTKDM4EALDH1A1USP2HSD17B10
SCHEMBL7293097 0.70 STK10 (0.40)
SCHEMBL7197852 0.69 SIRT2 (0.49) MAPTCA12CA1CA2CA4
SCHEMBL8323450 0.69 STK10 (0.41) MAPTKDM4EALDH1A1USP2HSD17B10

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0526708-B1 Sulfonamide, preparation and use thereof as medicine and intermediate HOFFMANN LA ROCHE (CH) 2000-10-18 EP disclosed
US-5292740-A Sulfonamides HOFFMANN-LA ROCHE INC. (US) 1994-03-08 US disclosed
EP-0526708-A1 Sulfonamide, preparation and use thereof as medicine and intermediate F. HOFFMANN-LA ROCHE AG (CH) 1993-02-10 EP disclosed