SCHEMBL3400645

SCHEMBL3400645

CCOC(c1ccc(-c2ccccc2-c2nnn[nH]2)cc1)c1nc2cccc(C(=O)OC(C)OC(=O)OC3CCCCC3)c2[nH]1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PPARG P37231 2/20 0.51
KDM4E B2RXH2 1/20 0.51
MEN1 O00255 1/20 0.51
MLNR O43193 1/20 0.51
NR1I2 O75469 1/20 0.51
USP2 O75604 1/20 0.51
ESR1 P03372 1/20 0.51
NR3C1 P04150 1/20 0.51
TP53 P04637 1/20 0.51
PGR P06401 1/20 0.51
ADRB2 P07550 1/20 0.51
CHRM2 P08172 1/20 0.51
ADRB1 P08588 1/20 0.51
CYP3A4 P08684 1/20 0.51
HTR1A P08908 1/20 0.51
ADRA2A P08913 1/20 0.51
ADORA3 P0DMS8 1/20 0.51
GABRA1 P14867 1/20 0.51
HPGD P15428 1/20 0.51
ALOX15 P16050 1/20 0.51

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
SCHEMBL8836872 0.83 BRS3 (0.33) PPARGCYP3A4ADORA3ADRA2BSLC6A2
SCHEMBL9291479 0.83 PARP1 (0.35) PPARGCYP3A4ADORA3ADRA2BSLC6A2
SCHEMBL844427 0.82 ABCB11 (0.38) PPARGCYP3A4ADORA3ADRA2BSLC6A2
Candesartan Cilexetil SCHEMBL1021483 0.79 NAE1 (0.79) PPARGKDM4EMEN1MLNRNR1I2
Candesartan Cilexetil SCHEMBL40831 0.79 NAE1 (0.79) PPARGKDM4EMEN1MLNRNR1I2
Candesartan Cilexetil SCHEMBL3968703 0.79 NAE1 (0.79) PPARGKDM4EMEN1MLNRNR1I2
Candesartan Cilexetil SCHEMBL16949997 0.79 NAE1 (0.79) PPARGKDM4EMEN1MLNRNR1I2
Candesartan Cilexetil SCHEMBL6515280 0.78 NAE1 (0.78) PPARGKDM4EMEN1MLNRNR1I2
SCHEMBL12181757 0.78 PPARG (0.67) PPARGKDM4EMEN1MLNRNR1I2
SCHEMBL9197579 0.78 KDM4E (0.66) PPARGKDM4EMEN1MLNRNR1I2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2253327-A1 Pharmaceutical composition containing a compound having angiotensin II antagonistic activity in combination with another compound Takeda Pharmaceutical Company Limited (JP) 2010-11-24 EP disclosed
EP-1306089-B1 Combination of benzimidazoles having angiotensin-II antagonistic activity with diuretics TAKEDA PHARMACEUTICAL (JP) 2007-09-05 EP disclosed
EP-1813286-A2 Pharmaceutical composition containing a compound having angiotensin II antagonistic activity in combination with another compound Takeda Pharmaceutical Company Limited (JP) 2007-08-01 EP disclosed
EP-0914158-B2 PHARMACEUTICAL COMBINATION CONTAINING A COMPOUND HAVING ANGIOTENSIN II ANTAGONISTIC ACTIVITY AND A COMPOUND WHICH INCREASES THE INSULIN-SENSITIVITY TAKEDA CHEMICAL INDUSTRIES LTD (JP) 2006-01-25 EP disclosed
US-20040219208-A1 Sustained-release medicines TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2004-11-04 US disclosed
US-6432996-B1 ADMINISTERING BENZIMIDAZOLE DERIVATIVE ANGIOTENSIN II ANTAGONIST, INDANE DERIVATIVE ANGIOTENSIN CONVERTING ENZYME INHIBITOR, AND PYRIDINE DERIVATIVE HMG-CO A REDUCTASE INHIBITOR TO TREAT PROSTPRANDIAL HYPERGLYCEMIA IN DIABETES TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 2002-08-13 US disclosed
EP-0914158-B1 PHARMACEUTICAL COMBINATION CONTAINING A COMPOUND HAVING ANGIOTENSIN II ANTAGONISTIC ACTIVITY AND A COMPOUND WHICH INCREASES THE INSULIN-SENSITIVITY TAKEDA CHEMICAL INDUSTRIES LTD (JP) 2002-07-10 EP disclosed
EP-1192951-A2 Pharmaceutical composition containing a compound having angiotensin II antagonistic activity in combination with another compound Takeda Chemical Industries, Ltd. (JP) 2002-04-03 EP disclosed
US-6107323-A PREVENTING OR TREATING ANGIOTENSIN DISEASES BY ADMINISTERING AN ANTAGONIST AND COMPOUND WHICH INCREASES INSULIN SENSITIVITY TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 2000-08-22 US disclosed
EP-0914158-A2 PHARMACEUTICAL COMBINATION CONTAINING A COMPOUND HAVING ANGIOTENSIN II AND ANTAGONISTIC ACTIVITY Takeda Chemical Industries, Ltd. (JP) 1999-05-12 EP disclosed
WO-1997037688-A2 PHARMACEUTICAL COMBINATION CONTAINING A COMPOUND HAVING ANGIOTENSIN II AND ANTAGONISTIC ACTIVITY TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1997-10-16 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20040219208-A1 Sustained-release medicines ACE, AGTR2, AGT PPARG 875/4885KDM4E 2132/4885MEN1 102/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.