SCHEMBL7280843

SCHEMBL7280843

c1ccc(OCCNc2nc(-n3ccnc3)nc3ccccc23)cc1

nearest known ligand 0.71

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
PDE5A O76074 18/20 0.71
TBXAS1 P24557 3/20 0.67
PDE3B Q13370 3/20 0.67
PDE3A Q14432 3/20 0.67
PTGS1 P23219 1/20 0.67
PTGS2 P35354 1/20 0.67
GBA1 P04062 2/20 0.55

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
SCHEMBL7280500 0.93 PDE5A (0.62) PDE5ATBXAS1PDE3BPDE3APTGS1
SCHEMBL7289858 0.89 PDE5A (0.57) PDE5ATBXAS1PDE3BPDE3APTGS1
SCHEMBL7280221 0.88 PDE5A (0.70) PDE5ATBXAS1PDE3BPDE3APTGS1
SCHEMBL7290371 0.87 PDE5A (0.56) PDE5ATBXAS1PDE3BPDE3APTGS1
SCHEMBL7278005 0.87 PDE5A (0.71) PDE5ATBXAS1PDE3BPDE3APTGS1
SCHEMBL7289552 0.87 PDE5A (0.56) PDE5ATBXAS1PDE3BPDE3APTGS1
SCHEMBL7279816 0.87 PDE5A (0.59) PDE5ATBXAS1PDE3BPDE3APTGS1
SCHEMBL7439183 0.87 PDE5A (0.73) PDE5ATBXAS1PDE3BPDE3APTGS1
SCHEMBL7278130 0.87 PDE5A (0.75) PDE5ATBXAS1PDE3BPDE3APTGS1
Hydrochloric Acid SCHEMBL7442487 0.86 PDE5A (0.73) PDE5ATBXAS1PDE3BPDE3APTGS1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0579496-B1 4-Aminoquinazoline derivatives, and their use as medicine ONO PHARMACEUTICAL CO (JP) 2001-11-14 EP claimed
US-5436233-A Nervous system disorders ONO PHARMACEUTICAL CO., LTD. (JP) 1995-07-25 US claimed
EP-0579496-A1 4-Aminoquinazoline derivatives, and their use as medicine ONO PHARMACEUTICAL CO., LTD. (JP) 1994-01-19 EP claimed