SCHEMBL9726544

SCHEMBL9726544

CC=CC=CC(=O)CC(O)CC(=O)OC

nearest known ligand 0.35

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
OXER1 Q8TDS5 2/20 0.35
CNR2 P34972 4/20 0.34
CNR1 P21554 2/20 0.34
PPARG P37231 1/20 0.34
PPARD Q03181 1/20 0.34
PPARA Q07869 1/20 0.34
ALOX5 P09917 1/20 0.32
TSHR P16473 1/20 0.31
POLB P06746 1/20 0.30
POLA1 P09884 1/20 0.30

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
SCHEMBL9726541 1.00 OXER1 (0.35) OXER1CNR2CNR1PPARGPPARD
SCHEMBL13071309 0.87 TSHR (0.34) TSHRPOLBPOLA1
SCHEMBL9726788 0.80 SLC22A6 (0.50) CNR2CNR1PPARGPPARDPPARA
SCHEMBL9726786 0.80 SLC22A6 (0.50) CNR2CNR1PPARGPPARDPPARA
SCHEMBL27257986 0.80 SLC1A1 (0.34) OXER1CNR2CNR1PPARGPPARD
SCHEMBL28243 0.77 TSHR (0.50) TSHR
SCHEMBL10300852 0.75 CNR2 (0.40) CNR2CNR1PPARGPPARDPPARA
SCHEMBL1874566 0.75 CNR2 (0.40) CNR2CNR1PPARGPPARDPPARA
SCHEMBL9726956 0.75 TSHR (0.34) TSHR
SCHEMBL9726959 0.75 TSHR (0.34) TSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5110940-A Inhibitors of 3-hydroxy-3-methylglutaryl coenzyme A reductase BRISTOL-MYERS COMPANY (US) 1992-05-05 US disclosed
US-5068346-A Anticholesterol agents BRISTOL-MYERS COMPANY (US) 1991-11-26 US disclosed
US-4898950-A Preparation of antihypercholesterolemic tetrazole compounds BRISTOL-MYERS COMPANY (US) 1990-02-06 US disclosed
US-4897490-A DERIVATIVES OF BETA-HYDROXY,OMEGA-DIPHENYL,TETRAZOL-5-YL ALK-OMEGA-ENOIC ACID, ESTER OR LACTONE BRISTOL-MEYERS COMPANY (US) 1990-01-30 US disclosed
CN-1036013-A The tetrazole compound that antihypercholesterolemic is too high and the preparation of intermediate thereof BRISTOL MYERS CO (US) 1989-10-04 CN disclosed
US-4824959-A Intermediates for antihypercholesterolemic tetrazole compounds BRISTOL-MYERS COMPANY (US) 1989-04-25 US disclosed
CN-88100911-A Antihypercholesterolemic tetrazolium compounds 1988-09-28 CN disclosed
WO-1988006584-A1 ANTIHYPERCHOLESTEROLEMIC TETRAZOLE COMPOUNDS BRISTOL-MYERS COMPANY (US) 1988-09-07 WO disclosed