SCHEMBL9763025

SCHEMBL9763025

CON=C(Nc1nc(OC)nc(OC)n1)NS(=O)(=O)c1ccccc1Cl

nearest known ligand 0.63

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 2/20 0.48
ALDH1A1 P00352 2/20 0.48
NPC1 O15118 1/20 0.48
MEN1 O00255 1/20 0.42
KMT2A Q03164 1/20 0.42
CCR4 P51679 2/20 0.39
MAPT P10636 2/20 0.39
LMNA P02545 1/20 0.39
POLB P06746 1/20 0.37
FLT1 P17948 1/20 0.37
FLT4 P35916 1/20 0.37
KDR P35968 1/20 0.37
CA12 O43570 1/20 0.36
CA1 P00915 1/20 0.36
CA2 P00918 1/20 0.36
CA9 Q16790 1/20 0.36
HTR6 P50406 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
SCHEMBL9763397 0.94 KDM4E (0.46) KDM4EALDH1A1NPC1MEN1KMT2A
SCHEMBL9763671 0.86 GAA (0.48) KDM4EALDH1A1NPC1MEN1KMT2A
SCHEMBL11035534 0.86 MAPT (0.36) KDM4EALDH1A1NPC1MEN1KMT2A
SCHEMBL10848509 0.86 MAPT (0.36) KDM4EALDH1A1NPC1MEN1KMT2A
SCHEMBL11035297 0.85 EDNRA (0.42) KDM4EALDH1A1NPC1MAPT
SCHEMBL10836053 0.85 EDNRA (0.42) KDM4EALDH1A1NPC1MAPT
SCHEMBL10866717 0.84 SMN1; SMN2 (0.48) KDM4EALDH1A1NPC1CCR4MAPT
SCHEMBL11636558 0.83 ALDH1A1 (0.66) KDM4EALDH1A1NPC1MEN1KMT2A
SCHEMBL10865825 0.81 GAA (0.43) KDM4EALDH1A1NPC1MAPTLMNA
SCHEMBL10837079 0.80 EDNRA (0.39) MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4988379-A Pre- and postemergent BAYER AKTIENGESELLSCHAFT (DE) 1991-01-29 US disclosed
US-4840661-A Sulphonyliso(thio)urea derivatives and herbicidal use thereof BAYER AKTIENGESELLSCHAFT (DE) 1989-06-20 US disclosed
EP-0173957-B1 SULFONYLISO(THIO) UREA DERIVATIVES BAYER AG (DE) 1989-01-18 EP disclosed
US-4725305-A PLANT GROWTH REGULATORS BAYER AKTIENGESELLSCHAFT (DE) 1988-02-16 US disclosed