SCHEMBL7825993

SCHEMBL7825993

CCOC(=O)CCc1c(C)nc(CC)nc1O

nearest known ligand 0.47

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 1/20 0.47
TSHR P16473 2/20 0.46
ALDH1A1 P00352 3/20 0.43
HSD17B10 Q99714 2/20 0.43
MEN1 O00255 2/20 0.42
KMT2A Q03164 2/20 0.42
RXFP1 Q9HBX9 1/20 0.42
MAPT P10636 3/20 0.40
MAPK1 P28482 1/20 0.40
CYP4F2 P78329 2/20 0.40
CYP4A11 Q02928 2/20 0.40
GAA P10253 1/20 0.39
KDM4E B2RXH2 3/20 0.39
HPGD P15428 1/20 0.38
POLB P06746 1/20 0.38

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
SCHEMBL31663230 0.84 L3MBTL1 (0.49) L3MBTL1TSHRALDH1A1HSD17B10MEN1
SCHEMBL7819539 0.84 MAPK1 (0.52) L3MBTL1TSHRALDH1A1HSD17B10KMT2A
SCHEMBL31663014 0.83 L3MBTL1 (0.48) L3MBTL1TSHRALDH1A1HSD17B10MEN1
SCHEMBL27834208 0.79 L3MBTL1 (0.52) L3MBTL1TSHRALDH1A1HSD17B10MEN1
SCHEMBL27834209 0.74 L3MBTL1 (0.55) L3MBTL1TSHRALDH1A1HSD17B10MEN1
SCHEMBL4686439 0.74 MAPK1 (0.48) L3MBTL1TSHRALDH1A1HSD17B10MAPK1
SCHEMBL22587359 0.72 POLB (0.51) L3MBTL1TSHRALDH1A1HSD17B10MEN1
SCHEMBL8803148 0.71 L3MBTL1 (0.48) L3MBTL1TSHRALDH1A1HSD17B10MEN1
SCHEMBL31663340 0.71 TSHR (0.50) L3MBTL1TSHRALDH1A1HSD17B10MEN1
SCHEMBL22587326 0.71 ALDH1A1 (0.55) L3MBTL1TSHRALDH1A1HSD17B10MEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0781276-B1 PYRIMIDINONE DERIVATIVES BORYUNG PHARM (KR) 2001-12-12 EP disclosed
US-5869476-A ANGIOTENSIN II ANTAGONISTS; TREATING CARDIOVASCULAR DISORDERS BORYUNG PHARMACEUTICAL CO., LTD. (KR) 1999-02-09 US disclosed
EP-0781276-A1 PYRIMIDINONE DERIVATIVES BORYUNG PHARMACEUTICAL CO., LTD. (KR) 1997-07-02 EP disclosed
WO-1996008476-A1 PYRIMIDINONE DERIVATIVES BORYUNG PHARMACEUTICAL CO., LTD. (KR) 1996-03-21 WO disclosed