SCHEMBL8550701

SCHEMBL8550701

CCOC(=O)c1cnn(C)c1N(C)c1ccc(-c2ccccc2C#N)cc1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 13/20 0.41
KDM4E B2RXH2 13/20 0.41
L3MBTL1 Q9Y468 8/20 0.40
MAPT P10636 2/20 0.40
MEN1 O00255 2/20 0.40
KMT2A Q03164 2/20 0.40
TDP1 Q9NUW8 6/20 0.39
HPGD P15428 6/20 0.39
LMNA P02545 4/20 0.39
NPSR1 Q6W5P4 1/20 0.39
MAP2K1 Q02750 2/20 0.39
GRIA2 P42262 1/20 0.39
GRIA4 P48058 1/20 0.39
SMN1; SMN2 Q16637 3/20 0.39
HTT P42858 2/20 0.39
NPC1 O15118 2/20 0.39
NFKB1 P19838 2/20 0.39
RAB9A P51151 2/20 0.39
NFKB2 Q00653 2/20 0.39
RELA Q04206 2/20 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
SCHEMBL8552171 0.83 MAP2K1 (0.40) ALDH1A1KDM4EL3MBTL1MAPTMEN1
SCHEMBL7437541 0.80 KDM4E (0.50) ALDH1A1KDM4EMAPTHPGDLMNA
SCHEMBL8550700 0.78 KDM4E (0.49) ALDH1A1KDM4EL3MBTL1MAPTTDP1
SCHEMBL30443795 0.77 ALDH1A1 (0.46) ALDH1A1KDM4EL3MBTL1MAPTMEN1
SCHEMBL29024296 0.77 ALDH1A1 (0.46) ALDH1A1KDM4EL3MBTL1MAPTMEN1
SCHEMBL8417432 0.74 ALDH1A1 (0.41) ALDH1A1KDM4EL3MBTL1MAPTTDP1
SCHEMBL4370965 0.71 GRIA2 (0.49) ALDH1A1KDM4EL3MBTL1MAPTMEN1
SCHEMBL2604 0.70 NLRP3 (0.41) ALDH1A1KDM4EL3MBTL1MAPTTDP1
SCHEMBL2104 0.70 NLRP3 (0.43) ALDH1A1KDM4EL3MBTL1MAPTGRIA2
SCHEMBL7436474 0.69 AXL (0.41) ALDH1A1HPGDLMNAGRIA2GRIA4

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-0588299-B1 1,2,4-Oxadiazolyl- or 1,2,4-thiadiazolyl-biphenyl derivatives as angiotensin II antagonists TAKEDA CHEMICAL INDUSTRIES LTD (JP) 1998-07-01 EP disclosed
EP-0829479-A1 Heterocyclic compounds and their use as angiotensin II antagonists TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1998-03-18 EP disclosed
US-5500427-A ANGIOTENSIN II ANTAGONISTS TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1996-03-19 US disclosed
EP-0588299-A2 1,2,4-Oxadiazolyl- or 1,2,4-thiadiazolyl-biphenyl derivatives as angiotensin II antagonists TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1994-03-23 EP disclosed