SCHEMBL9256897

SCHEMBL9256897

CCOC(=O)c1cccnc1NC(CC)Cc1ccc(-c2ccccc2C(=O)c2nnn[nH]2)cc1

nearest known ligand 0.41

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
HTT P42858 1/20 0.41
AGTR1 P30556 7/20 0.39
AGTR2 P50052 7/20 0.39
BDKRB1 P46663 8/20 0.38
PPIA P62937 1/20 0.36
HSD17B10 Q99714 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
SCHEMBL9255659 0.90 BRS3 (0.40) AGTR1AGTR2BDKRB1
SCHEMBL6609722 0.77 HTT (0.41) HTTAGTR1AGTR2BDKRB1PPIA
SCHEMBL6607743 0.77 HTT (0.41) HTTAGTR1AGTR2BDKRB1PPIA
SCHEMBL9256905 0.76 AGTR1 (0.59) AGTR1AGTR2
SCHEMBL1523210 0.74 HTT (0.61) HTTPPIAHSD17B10
SCHEMBL8826228 0.73 HTT (0.47) HTTPPIAHSD17B10
SCHEMBL8944331 0.71 AGTR1 (0.51) AGTR1AGTR2
SCHEMBL8944158 0.70 JMJD6 (0.39) AGTR1AGTR2
SCHEMBL8944447 0.69 AGTR1 (0.36) AGTR1AGTR2
SCHEMBL9596670 0.68 HTT (0.46) HTTPPIAHSD17B10

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5459148-A Cardiovascular disorders SANKYO COMPANY, LIMITED (JP) 1995-10-17 US disclosed
EP-0603001-A1 Biphenyl derivatives, their preparation and their use for the treatment of hypertension and cardiac disease SANKYO COMPANY LIMITED (JP) 1994-06-22 EP disclosed