SCHEMBL7014160

SCHEMBL7014160

CCSc1nc2c(C)sc(C(=O)OCOC)c2[nH]1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CSNK2A2 P19784 3/20 0.41
CSNK2A1 P68400 3/20 0.41
CSNK2B P67870 2/20 0.41
TSHR P16473 2/20 0.36
ALDH1A1 P00352 7/20 0.35
KDM4E B2RXH2 4/20 0.35
POLB P06746 1/20 0.35
CYP1A2 P05177 3/20 0.34
HPGD P15428 4/20 0.34
MAPT P10636 4/20 0.34
KMT2A Q03164 2/20 0.34
MEN1 O00255 1/20 0.34
L3MBTL1 Q9Y468 1/20 0.34
HSD17B10 Q99714 2/20 0.33
GAA P10253 1/20 0.33
KDM4C Q9H3R0 1/20 0.33
LMNA P02545 1/20 0.32
MC4R P32245 1/20 0.32
RAB9A P51151 1/20 0.32
CYP3A4 P08684 2/20 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
SCHEMBL7014162 0.91 CSNK2A2 (0.41) CSNK2A2CSNK2A1CSNK2BTSHRALDH1A1
SCHEMBL7012347 0.88 CSNK2A2 (0.41) CSNK2A2CSNK2A1CSNK2BTSHRALDH1A1
SCHEMBL9031604 0.78 CSNK2A2 (0.40) CSNK2A2CSNK2A1CSNK2BTSHRALDH1A1
SCHEMBL7012345 0.78 CSNK2A2 (0.41) CSNK2A2CSNK2A1CSNK2BTSHRALDH1A1
SCHEMBL9033546 0.76 TSHR (0.46) CSNK2A2CSNK2A1CSNK2BTSHRALDH1A1
SCHEMBL9031570 0.74 GPR84 (0.45) TSHRCYP1A2CYP3A4CYP2C9CYP2C19
SCHEMBL9032276 0.74 HPGD (0.44) CSNK2A2CSNK2A1CSNK2BTSHRALDH1A1
SCHEMBL9031786 0.73 CSNK2A2 (0.38) CSNK2A2CSNK2A1CSNK2BALDH1A1KDM4E
SCHEMBL9031779 0.73 CSNK2A2 (0.41) CSNK2A2CSNK2A1CSNK2BTSHRALDH1A1
SCHEMBL9258897 0.72 CSNK2A2 (0.41) CSNK2A2CSNK2A1CSNK2BTSHRALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0520423-B1 Heterocyclic compounds, their production and use as angiotensin II antagonists TAKEDA CHEMICAL INDUSTRIES LTD (JP) 2003-05-14 EP disclosed
US-6100252-A SPECIFIED COMPOUNDS INCLUDING METHYL 2-BUTYL-1-((2'-(2-OXO-3H-1,2,3,5-OXATHIADIAZOL-4-YL)BIPHENYL) METHYL)-BENZIMIDAZOLE-7-CARBOXYLATE; USE TO TREAT CIRCULATORY DISEASES SUCH AS HYPERTENSIVE DISEASES AND HEART DISEASES TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 2000-08-08 US disclosed
US-5583141-A ADMINISTERING AS THERAPEUTIC AGENTS OF CIRCULATORY DISEASES; AZILSARTAN; ANGIOTENSIN II ANTAGONISTS TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1996-12-10 US disclosed
US-5354766-A 2-Ethoxy-1-((2'(2,5-dihydro-5-oxo-1,2,4-oxadiazol-3-yl) biphenyl-4-yl)methyl)benzimidazole-7-carboxylic acid; hypotensive agents; CNS activity TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1994-10-11 US disclosed
US-5243054-A Hypotensive agents, cardiovascular disorders or nervous system disorders TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1993-09-07 US disclosed
EP-0520423-A2 Heterocyclic compounds, their production and use as angiotensin II antagonists TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1992-12-30 EP disclosed