SCHEMBL7085291

SCHEMBL7085291

Cc1c(C)c2c(c(C)c1OCc1ccccc1)CCC(C)(CCN(C)CCOc1ccc(N)cc1)O2

nearest known ligand 0.40

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.37
RAB9A P51151 2/20 0.37
GAA P10253 1/20 0.37
MAOA P21397 1/20 0.37
MAOB P27338 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
L3MBTL1 Q9Y468 1/20 0.37
PSEN1 P49768 5/20 0.37
KCNH2 Q12809 2/20 0.35
MCHR1 Q99705 2/20 0.35
MEN1 O00255 2/20 0.35
KMT2A Q03164 2/20 0.35
TDP1 Q9NUW8 1/20 0.35
PPARG P37231 2/20 0.35
PPARD Q03181 1/20 0.35
PPARA Q07869 1/20 0.35
TSHR P16473 1/20 0.35
ALOX5 P09917 2/20 0.34
NPC1 O15118 1/20 0.34

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
SCHEMBL6980438 0.92 MAPT (0.38) MAPTRAB9AGAAMAOAMAOB
SCHEMBL6968782 0.89 PPARG (0.39) MAPTMAOBPSEN1KCNH2MCHR1
SCHEMBL6970202 0.88 KCNH2 (0.45) MAPTSMN1; SMN2PSEN1KCNH2MCHR1
SCHEMBL6975335 0.85 KCNH2 (0.39) MAPTRAB9AGAAMAOAMAOB
SCHEMBL6979341 0.85 PSEN1 (0.42) MAPTPSEN1MEN1KMT2ATDP1
SCHEMBL8484423 0.85 PSEN1 (0.42) MAPTPSEN1MEN1KMT2ATDP1
SCHEMBL6968631 0.85 PSEN1 (0.40) MAPTPSEN1MEN1KMT2ATDP1
SCHEMBL6979687 0.84 HPGD (0.50) MAOAMAOBMEN1KMT2APPARG
SCHEMBL6967821 0.84 HPGD (0.50) MAOAMAOBMEN1KMT2APPARG
SCHEMBL6979165 0.84 PPARG (0.40) MAPTL3MBTL1PSEN1MEN1KMT2A

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
EP-0801063-B1 Thiazolidinedione derivatives having antidiabetic, hypolipidaemic, antihypertensive properties, process for their preparation and pharmaceutical compositions containing them REDDYS LAB LTD DR (IN) 2003-01-15 EP disclosed
EP-0801063-A1 Thiazolidinedione derivatives having antidiabetic, hypolipidaemic antihypertensive properties, process for their preparation and pharmaceutical compositions containing them DR. REDDY'S RESEARCH FOUNDATION (IN) 1997-10-15 EP disclosed