SCHEMBL8809696

SCHEMBL8809696

O=C1NC(Cc2cn(Cc3ccc(OCc4ccccc4)cc3)c3ccccc23)C(=O)S1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PPARG P37231 3/20 0.41
PPARD Q03181 3/20 0.41
PPARA Q07869 3/20 0.41
MEN1 O00255 3/20 0.41
KMT2A Q03164 3/20 0.41
MAPK1 P28482 1/20 0.41
HTT P42858 1/20 0.41
NPSR1 Q6W5P4 1/20 0.41
CHRNB2 P17787 2/20 0.40
CHRNA7 P36544 2/20 0.40
CHRNA4 P43681 2/20 0.40
MAPK14 Q16539 1/20 0.40
KDM4C Q9H3R0 1/20 0.40
HTR6 P50406 2/20 0.39
POLB P06746 1/20 0.39
CYP19A1 P11511 1/20 0.39
PDE4A P27815 1/20 0.39
PDE4B Q07343 1/20 0.39
PDE4C Q08493 1/20 0.39
PDE4D Q08499 1/20 0.39

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
SCHEMBL8685513 0.90 CYP19A1 (0.47) MEN1KMT2ANPSR1CHRNB2CHRNA7
SCHEMBL8811937 0.89 MAPK14 (0.43) PPARGPPARDPPARAMEN1KMT2A
SCHEMBL8811671 0.86 CHRNB2 (0.51) NPSR1CHRNB2CHRNA7CHRNA4POLB
SCHEMBL8810496 0.85 HTR6 (0.49) HTTNPSR1HTR6CYP19A1MAPT
SCHEMBL8813439 0.84 HTR6 (0.50) MEN1KMT2AHTTCHRNB2CHRNA7
SCHEMBL8810585 0.84 PARP1 (0.51) MEN1KMT2AMAPK1HTTNPSR1
SCHEMBL8812059 0.83 CYP19A1 (0.50) MEN1KMT2AHTTNPSR1POLB
SCHEMBL8811167 0.81 HTR6 (0.53) CHRNB2CHRNA7CHRNA4HTR6POLB
SCHEMBL8811297 0.81 MAPT (0.48) KMT2ACHRNB2CHRNA7CHRNA4HTR6
SCHEMBL8809683 0.81 FFAR1 (0.57) PPARGPPARDPPARA

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
EP-0780389-A1 Thiazolidinedione derivatives, process for their preparation and pharmaceutical compositions containing them TOBISHI PHARMACEUTICAL CO., LTD. (JP) 1997-06-25 EP disclosed