SCHEMBL8906071

SCHEMBL8906071

CCCc1nc2ccc(-c3nccn3C3CCCCC3)cc2n1-c1cccc(-c2ccccc2-c2nnn[nH]2)c1C

nearest known ligand 0.34

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
PIK3R2 O00459 1/20 0.30

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
SCHEMBL8907819 0.98 PIK3R2 (0.31) PIK3R2
SCHEMBL8906067 0.89 PLK1 (0.31)
SCHEMBL8905654 0.88 PPARG (0.31) PIK3R2
SCHEMBL8907540 0.87 CYP3A4 (0.31) PIK3R2
SCHEMBL8907815 0.85 CYP1A2 (0.32) PIK3R2
SCHEMBL8788807 0.85 PPARG (0.43)
SCHEMBL8905660 0.84 CYP3A4 (0.33)
SCHEMBL8906482 0.84 PPARG (0.43)
SCHEMBL8905761 0.84 AGTR1 (0.33)
SCHEMBL8905781 0.83

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5684029-A HYPOTENSIVE AGENTS KARL THOMAE GMBH (DE) 1997-11-04 US disclosed