SCHEMBL7879967

SCHEMBL7879967

CCc1nccc(-c2ccc(C(=O)N3CCN(CC)CC3)c(Cl)c2)c1-c1ccc(N)nc1

nearest known ligand 0.61

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
MTOR P42345 20/20 0.61
PIK3CA P42336 10/20 0.61

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
SCHEMBL7877439 0.92 MTOR (0.62) MTORPIK3CA
SCHEMBL7873083 0.90 MTOR (0.74) MTOR
SCHEMBL7879485 0.88 MTOR (0.75) MTORPIK3CA
SCHEMBL10157641 0.86 PIK3CA (0.75) MTORPIK3CA
SCHEMBL12773440 0.85 MTOR (0.65) MTORPIK3CA
SCHEMBL695578 0.85 MTOR (0.83) MTORPIK3CA
SCHEMBL7876711 0.83 MTOR (0.56) MTORPIK3CA
SCHEMBL12774566 0.81 MTOR (0.73) MTORPIK3CA
SCHEMBL7870159 0.81 MTOR (0.73) MTORPIK3CA
SCHEMBL12773424 0.81 MTOR (0.75) MTOR

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
WO-2010122069-A1 5-ALKYNYL-PYRIDINES BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2010-10-28 WO disclosed