SCHEMBL7276820

SCHEMBL7276820

CCOC(=O)C=Cc1c(N)cc(CC)nc1CC

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CNKSR1 Q969H4 1/20 0.51
DPP4 P27487 2/20 0.41
TTR P02766 1/20 0.41
CA12 O43570 1/20 0.40
CA1 P00915 1/20 0.40
CA2 P00918 1/20 0.40
CA7 P43166 1/20 0.40
CA9 Q16790 1/20 0.40
CA14 Q9ULX7 1/20 0.40
CYP3A4 P08684 2/20 0.39
P2RY12 Q9H244 1/20 0.38
MAOB P27338 1/20 0.38
PTGS2 P35354 1/20 0.37
CYP1A2 P05177 1/20 0.36
CYP2D6 P10635 1/20 0.36
CYP2C9 P11712 1/20 0.36
HSD17B1 P14061 1/20 0.36
CYP2C19 P33261 1/20 0.36
HSD17B2 P37059 1/20 0.36
KDM4E B2RXH2 1/20 0.36

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
SCHEMBL30757482 1.00 CNKSR1 (0.51) CNKSR1DPP4TTRCA12CA1
SCHEMBL12083630 0.77 CNKSR1 (0.51) CNKSR1DPP4TTRCA12CA1
SCHEMBL3179969 0.74 NOS3 (0.39)
SCHEMBL13304571 0.72 CNKSR1 (0.48) CNKSR1DPP4TTRCA12CA1
SCHEMBL16750522 0.70 CA12 (0.48) CNKSR1DPP4TTRCA12CA1
SCHEMBL14370627 0.69 CNKSR1 (0.54) CNKSR1DPP4TTRCA12CA1
SCHEMBL29155777 0.68 CNKSR1 (0.51) CNKSR1DPP4TTRCA12CA1
SCHEMBL29830043 0.68 CNKSR1 (0.51) CNKSR1DPP4TTRCA12CA1
SCHEMBL15811519 0.68 CNKSR1 (1.00) CNKSR1DPP4TTRCA12CA1
SCHEMBL2775389 0.67 CA12 (0.51) CNKSR1DPP4TTRCA12CA1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0516392-B1 Naphthyridine derivatives as angiotensin II inhibitors ASTRAZENECA AB (SE) 2001-08-29 EP disclosed
EP-0520724-B1 Angiotensin II antagonists ZENECA LTD (GB) 1995-09-20 EP disclosed
US-5387592-A Angiotensin converting enzyme inhibitors, calcium channel blockers, diuretics and adrenergic blocking agents IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1995-02-07 US disclosed
US-5373015-A Treating hypertension and congestive heart failure IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1994-12-13 US disclosed
EP-0520723-B1 Angiotensin II antagonists ICI PLC (GB) 1994-06-01 EP disclosed
US-5294620-A Hypotensive agents or compounds for cardiovascular disorders IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1994-03-15 US disclosed
US-5281613-A Heterocyclic ring substituted benzofuran, benzothiofuran, or indole derivative IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1994-01-25 US disclosed
WO-1993024501-A1 PHOSPHORUS CONTAINING HETEROCYCLIC COMPOUNDS AS ANGIOTENSINS ANTAGONISTS ZENECA LIMITED (GB) 1993-12-09 WO disclosed
WO-1993024487-A1 NITROGEN CONTAINING HETEROCYCLIC COMPOUNDS AS ANGIOTENSIN-II-ANTAGONISTS ZENECA LIMITED (GB) 1993-12-09 WO disclosed
CN-1073174-A Hete rocyclic derivatives ICI PLC (GB) 1993-06-16 CN disclosed
US-5217976-A Hypotensive agents, congestive heart failure IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1993-06-08 US disclosed
EP-0539066-A1 Heterocyclic compounds useful as angiotensin II antagonists ZENECA LIMITED (GB) 1993-04-28 EP disclosed
EP-0520723-A1 Angiotensin II antagonists IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1992-12-30 EP disclosed
EP-0520724-A1 Angiotensin II antagonists ZENECA LIMITED (GB) 1992-12-30 EP disclosed
EP-0516392-A2 Naphthyridine derivatives as angiotensin II inhibitors ZENECA LIMITED (GB) 1992-12-02 EP disclosed