SCHEMBL9826671

SCHEMBL9826671

COc1nc(C)nc(NC(=O)NS(=O)(=O)Nc2ccccc2CC2OCCO2)n1

nearest known ligand 0.53

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
ALOX15 P16050 1/20 0.36
TP53 P04637 2/20 0.33
GAA P10253 1/20 0.33
ALDH1A1 P00352 3/20 0.33
KDM4E B2RXH2 2/20 0.33
NPC1 O15118 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
MAPT P10636 1/20 0.32
HPGD P15428 1/20 0.32
HSD17B10 Q99714 1/20 0.32
PTK2 Q05397 1/20 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
SCHEMBL10944696 0.84 ALOX15 (0.42) ALOX15TP53GAANPC1SMN1; SMN2
SCHEMBL10945261 0.82 ALDH1A1 (0.42) ALOX15TP53ALDH1A1KDM4ENPC1
SCHEMBL10945094 0.81 MAPT (0.46) ALOX15SMN1; SMN2MAPTPTK2
SCHEMBL10948376 0.80 NPC1 (0.43) ALOX15TP53ALDH1A1KDM4ENPC1
SCHEMBL10946612 0.79 ALOX15 (0.43) ALOX15GAANPC1SMN1; SMN2MAPT
SCHEMBL1014139 0.79 ALOX15 (0.40) ALOX15ALDH1A1KDM4ESMN1; SMN2HPGD
SCHEMBL10946143 0.79 TSHR (0.46) GAAALDH1A1KDM4EMAPTHSD17B10
SCHEMBL1017166 0.79 ALOX15 (0.40) ALOX15TP53ALDH1A1KDM4ENPC1
SCHEMBL9222405 0.78 MAPT (0.38) ALOX15TP53ALDH1A1KDM4ENPC1
SCHEMBL8536335 0.77 ALOX15 (0.39) ALOX15TP53GAAALDH1A1KDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0184122-B1 SULFAMOYL UREA DERIVATIVES PPG INDUSTRIES, INC. (US) 1991-07-17 EP claimed
EP-0184122-A2 Sulfamoyl urea derivatives PPG INDUSTRIES, INC. (US) 1986-06-11 EP claimed
US-4559081-A PRE-AND POSTEMERGENCE HERBICIDES PPG INDUSTRIES, INC. (US) 1985-12-17 US claimed
EP-0184122-B1 SULFAMOYL UREA DERIVATIVES PPG INDUSTRIES, INC. (US) 1991-07-17 EP disclosed
US-4602939-A HERBICIDES PPG INDUSTRIES, INC. (US) 1986-07-29 US disclosed
EP-0184122-A2 Sulfamoyl urea derivatives PPG INDUSTRIES, INC. (US) 1986-06-11 EP disclosed
US-4559081-A PRE-AND POSTEMERGENCE HERBICIDES PPG INDUSTRIES, INC. (US) 1985-12-17 US disclosed