SCHEMBL7007876

SCHEMBL7007876

CCCc1nn2ncc(C(=O)OCC)c2[nH]1

nearest known ligand 0.46

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 7/20 0.46
RAB9A P51151 3/20 0.46
KDM4E B2RXH2 3/20 0.46
HPGD P15428 3/20 0.46
HIF1A Q16665 1/20 0.46
PLAT P00750 1/20 0.42
HSP90AA1 P07900 1/20 0.41
NPC1 O15118 2/20 0.41
LMNA P02545 2/20 0.41
KMT2A Q03164 3/20 0.40
MEN1 O00255 2/20 0.40
TSHR P16473 2/20 0.39
SMN1; SMN2 Q16637 1/20 0.39

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
SCHEMBL9304510 0.83 NR4A3 (0.35) ALDH1A1KDM4EPLAT
SCHEMBL7954127 0.83 ALDH1A1 (0.49) ALDH1A1RAB9AKDM4EHPGDHIF1A
SCHEMBL9140120 0.74 GLA (0.34) PLATKMT2A
SCHEMBL7101654 0.74 ALDH1A1 (0.46) ALDH1A1RAB9AKDM4EHPGDHIF1A
SCHEMBL7007883 0.71 KDM4E (0.46) ALDH1A1RAB9AKDM4EHPGDHSP90AA1
SCHEMBL8188074 0.68 KDM4E (0.50) ALDH1A1RAB9AKDM4EHPGDHIF1A
SCHEMBL23198901 0.68 KDM4E (0.56) ALDH1A1RAB9AKDM4EHPGDHIF1A
SCHEMBL1138081 0.67 ALDH1A1 (0.46) ALDH1A1RAB9AKDM4EHPGDHIF1A
SCHEMBL9585288 0.67 ALDH1A1 (0.52) ALDH1A1RAB9AKDM4EHPGDHIF1A
SCHEMBL26146309 0.67 ALDH1A1 (0.46) ALDH1A1RAB9AKDM4EHPGDHIF1A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1327631-A2 Fused heterocyclic compounds, their production and use as angiotensin II antagonists Takeda Chemical Industries, Ltd. (JP) 2003-07-16 EP disclosed
EP-0518033-B1 Fused heterocyclic compounds, their production and use TAKEDA CHEMICAL INDUSTRIES LTD (JP) 2003-07-02 EP disclosed
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-5389641-A Fused heterocyclic compounds, having angiotensin II antagonistic activity TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1995-02-14 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
EP-0518033-A1 Fused heterocyclic compounds, their production and use TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1992-12-16 EP disclosed