SCHEMBL6980211

SCHEMBL6980211

CCN(CCCl)CC1(C)CCc2c(C)c(OCc3ccccc3)c(C)c(C)c2O1

nearest known ligand 0.38

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
PSEN1 P49768 8/20 0.38
ALOX5 P09917 3/20 0.36
BCHE P06276 3/20 0.33
MEN1 O00255 1/20 0.33
MAPT P10636 1/20 0.33
KMT2A Q03164 1/20 0.33
TDP1 Q9NUW8 1/20 0.33
PPARG P37231 1/20 0.32
HPD P32754 1/20 0.32

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
SCHEMBL8483767 0.90 PSEN1 (0.40) PSEN1ALOX5MEN1MAPTKMT2A
SCHEMBL6969686 0.90 PSEN1 (0.40) PSEN1ALOX5MEN1MAPTKMT2A
SCHEMBL6979514 0.88 PSEN1 (0.39) PSEN1ALOX5BCHEMEN1MAPT
SCHEMBL6968210 0.88 PSEN1 (0.37) PSEN1ALOX5MEN1MAPTKMT2A
SCHEMBL6975335 0.85 KCNH2 (0.39) PSEN1ALOX5BCHEMEN1MAPT
SCHEMBL6968631 0.83 PSEN1 (0.40) PSEN1ALOX5MEN1MAPTKMT2A
SCHEMBL6976820 0.83 CYP1A2 (0.40) PSEN1ALOX5BCHEMEN1MAPT
SCHEMBL6967404 0.82 PSEN1 (0.37) PSEN1ALOX5MEN1MAPTKMT2A
SCHEMBL6977278 0.82 KCNH2 (0.45) PSEN1MEN1MAPTKMT2ATDP1
SCHEMBL8486214 0.81 PSEN1 (0.39) PSEN1ALOX5MEN1MAPTKMT2A

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 3 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
US-5925656-A CONTAINING A 2,4-DIOXOTRIAZOLIDINE RING DR. REDDY'S RESEARCH FOUNDATION (IN) 1999-07-20 US 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