SCHEMBL6979514

SCHEMBL6979514

[CH2]CN(CC)CC1(C)CCc2c(C)c(OCc3ccccc3)c(C)c(C)c2O1

nearest known ligand 0.39

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
PSEN1 P49768 8/20 0.39
ALOX5 P09917 3/20 0.37
MEN1 O00255 2/20 0.34
KMT2A Q03164 2/20 0.34
MAPT P10636 1/20 0.34
TDP1 Q9NUW8 1/20 0.34
PPARG P37231 1/20 0.33
PDE4A P27815 1/20 0.32
PDE3A Q14432 1/20 0.32
BCHE P06276 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 0.88 PSEN1 (0.40) PSEN1ALOX5MEN1KMT2AMAPT
SCHEMBL6980211 0.88 PSEN1 (0.38) PSEN1ALOX5MEN1KMT2AMAPT
SCHEMBL6969686 0.88 PSEN1 (0.40) PSEN1ALOX5MEN1KMT2AMAPT
SCHEMBL6975335 0.83 KCNH2 (0.39) PSEN1ALOX5MEN1KMT2AMAPT
SCHEMBL6967404 0.82 PSEN1 (0.37) PSEN1ALOX5MEN1KMT2AMAPT
SCHEMBL6976820 0.81 CYP1A2 (0.40) PSEN1ALOX5MEN1KMT2AMAPT
SCHEMBL8486214 0.81 PSEN1 (0.39) PSEN1ALOX5MEN1KMT2AMAPT
SCHEMBL29670864 0.81 PSEN1 (0.44) PSEN1ALOX5MEN1KMT2AMAPT
SCHEMBL7839568 0.81 PSEN1 (0.42) PSEN1ALOX5MEN1KMT2AMAPT
SCHEMBL11440558 0.81 PSEN1 (0.44) PSEN1ALOX5MEN1KMT2AMAPT

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