SCHEMBL9726788

SCHEMBL9726788

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

nearest known ligand 0.50

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
SLC22A6 Q4U2R8 1/20 0.50
MAPT P10636 1/20 0.39
GABRR1 P24046 2/20 0.39
LMNA P02545 1/20 0.39
GPR84 Q9NQS5 4/20 0.36
CNR2 P34972 4/20 0.33
CNR1 P21554 2/20 0.33
PPARG P37231 1/20 0.33
PPARD Q03181 1/20 0.33
PPARA Q07869 1/20 0.33
GRIK1 P39086 1/20 0.33
GRIK2 Q13002 1/20 0.33
SMN1; SMN2 Q16637 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
SCHEMBL9726786 1.00 SLC22A6 (0.50) SLC22A6MAPTGABRR1LMNAGPR84
SCHEMBL9726541 0.80 OXER1 (0.35) CNR2CNR1PPARGPPARDPPARA
SCHEMBL9726544 0.80 OXER1 (0.35) CNR2CNR1PPARGPPARDPPARA
SCHEMBL28051019 0.77 SLC22A6 (0.39) SLC22A6MAPT
SCHEMBL28710369 0.73 CNR2 (0.38) LMNACNR2CNR1PPARGPPARD
Malic Acid SCHEMBL23327984 0.72 SMN1; SMN2 (0.56) SLC22A6CNR2CNR1PPARGPPARD
SCHEMBL1883670 0.72 GPR84 (0.43) SLC22A6MAPTGABRR1LMNAGPR84
SCHEMBL1883672 0.72 GPR84 (0.43) SLC22A6MAPTGABRR1LMNAGPR84
Malic Acid SCHEMBL28810806 0.72 SMN1; SMN2 (0.56) SLC22A6CNR2CNR1PPARGPPARD
SCHEMBL13156318 0.72 GPR84 (0.43) SLC22A6MAPTGABRR1LMNAGPR84

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 5 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
US-4824959-A Intermediates for antihypercholesterolemic tetrazole compounds BRISTOL-MYERS COMPANY (US) 1989-04-25 US disclosed