SCHEMBL8690474

SCHEMBL8690474

O=C1NC(=O)C(Cc2ccc3c(ccn3CCc3ccccc3)c2)S1

nearest known ligand 0.60

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
FFAR1 O14842 9/20 0.60
PPARG P37231 7/20 0.60
ALDH1A1 P00352 1/20 0.45
NPSR1 Q6W5P4 1/20 0.45
MAPT P10636 1/20 0.44
PPARA Q07869 3/20 0.43
PTPN1 P18031 1/20 0.43
RORC P51449 1/20 0.42
CA2 P00918 1/20 0.41
MAOB P27338 1/20 0.41
MAOA P21397 1/20 0.41
CISD1 Q9NZ45 1/20 0.41

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
SCHEMBL8687856 0.91 FFAR1 (0.60) FFAR1PPARGALDH1A1NPSR1MAPT
SCHEMBL8686619 0.89 FFAR1 (0.57) FFAR1PPARGALDH1A1NPSR1MAPT
SCHEMBL14406531 0.83 FFAR1 (0.53) FFAR1PPARGALDH1A1NPSR1MAPT
SCHEMBL8685001 0.80 FFAR1 (0.58) FFAR1PPARGALDH1A1NPSR1MAPT
SCHEMBL8690479 0.78 KDM4C (0.42) FFAR1PPARGALDH1A1MAPTRORC
SCHEMBL8685774 0.78 FFAR1 (0.50) FFAR1PPARGMAPTPPARACA2
SCHEMBL6866703 0.77 PPARG (0.71) FFAR1PPARGALDH1A1NPSR1MAPT
SCHEMBL8686793 0.76 FFAR1 (0.47) FFAR1PPARGALDH1A1NPSR1MAPT
SCHEMBL8932654 0.76 PPARG (0.47) FFAR1PPARGALDH1A1NPSR1MAPT
SCHEMBL29547028 0.75 FFAR1 (1.00) FFAR1PPARGPPARA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5811439-A ANTIDIABETIC AGENTS; SIDE EFFECT REDUCTION; ANTILEPEMIC AGENTS SENGA PHARMACEUTICAL LABORATORY INC. (JP) 1998-09-22 US disclosed
EP-0780389-A1 Thiazolidinedione derivatives, process for their preparation and pharmaceutical compositions containing them TOBISHI PHARMACEUTICAL CO., LTD. (JP) 1997-06-25 EP disclosed