SCHEMBL11296017

SCHEMBL11296017

COc1cc(C(=O)O)oc1C

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HSD17B10 Q99714 3/20 0.54
TDP1 Q9NUW8 3/20 0.54
POLB P06746 3/20 0.54
L3MBTL1 Q9Y468 2/20 0.54
PIM1 P11309 1/20 0.50
APEX1 P27695 1/20 0.49
PTGER4 P35408 5/20 0.48
KDM4E B2RXH2 4/20 0.46
KMT2A Q03164 1/20 0.46
ALDH1A1 P00352 6/20 0.45
HPGD P15428 3/20 0.45
MAPT P10636 1/20 0.45
NPC1 O15118 3/20 0.44
RAB9A P51151 2/20 0.44
SMN1; SMN2 Q16637 2/20 0.44
MAPK1 P28482 1/20 0.44
CA12 O43570 2/20 0.42
CA1 P00915 2/20 0.42
CA2 P00918 2/20 0.42
CA4 P22748 2/20 0.42

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
SCHEMBL5150996 0.80 PIM1 (0.50) HSD17B10TDP1POLBL3MBTL1PIM1
SCHEMBL700764 0.74 APEX1 (0.55) HSD17B10TDP1POLBL3MBTL1APEX1
SCHEMBL4766674 0.73 PIM1 (0.55) HSD17B10PIM1KDM4EKMT2AALDH1A1
SCHEMBL14620144 0.72 APEX1 (0.53) HSD17B10TDP1POLBL3MBTL1APEX1
SCHEMBL11739986 0.72 PIM1 (0.50) HSD17B10TDP1POLBL3MBTL1PIM1
SCHEMBL8057737 0.72 PIM1 (0.70) HSD17B10TDP1POLBL3MBTL1PIM1
SCHEMBL29952181 0.71 APEX1 (0.52) HSD17B10TDP1POLBL3MBTL1PIM1
SCHEMBL12995249 0.71 APEX1 (0.52) HSD17B10TDP1POLBL3MBTL1PIM1
SCHEMBL10801943 0.71 PIM1 (0.56) HSD17B10TDP1POLBL3MBTL1PIM1
SCHEMBL18384672 0.71 PDE4A (0.55) HSD17B10TDP1PIM1KDM4EKMT2A

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
EP-0006305-B1 DERIVATIVES OF 4,5-DIHYDRO-4-OXOFURAN-2-CARBOXYLIC ACID, ESPECIALLY FOR USE AS HYPOLIPIDEMIC AGENTS, PROCESSES FOR THEIR PREPARATION, PHARMACEUTICAL COMPOSITIONS COMPRISING THEM, TETRAHYDROPYRAN-2,3,5-TRIONES USEFUL IN THE PREPARATION OF THE SAID DERIVATIVES AND A PROCESS FOR PREPARING THESE TETRAHYDROPYRAN-2,3,5-TRIONES AMERICAN HOME PRODUCTS CORPORATION (US) 1982-08-11 EP disclosed
US-4244958-A Hypolipidemic derivatives of 4,5-dihydro-4-oxofuran-2-carboxylic acid AMERICAN HOME PRODUCTS CORPORATION (US) 1981-01-13 US disclosed
WO-1980000025-A1 DERIVATIVES OF 4,5-DIHYDRO-4-OXOFURAN-2-CARBOXYLIC ACID,PREPARATIONS AND USE THEREOF AND TETRAHYDROPYRAN-2,3,5-TRIONE INTERMEDIATES AMERICAN HOME PROD (US) 1980-01-10 WO disclosed
EP-0006305-A1 Derivatives of 4,5-dihydro-4-oxofuran-2-carboxylic acid, especially for use as hypolipidemic agents, processes for their preparation, pharmaceutical compositions comprising them, tetrahydropyran-2,3,5-triones useful in the preparation of the said derivatives and a process for preparing these tetrahydropyran-2,3,5-triones AMERICAN HOME PRODUCTS CORPORATION (US) 1980-01-09 EP disclosed
US-4169202-A Process for preparing 4,5-dihydro-4-oxofuran-2-carboxylic acid derivatives AMERICAN HOME PRODUCTS CORPORATION (US) 1979-09-25 US disclosed