SCHEMBL7870159

SCHEMBL7870159

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

nearest known ligand 0.73

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
MTOR P42345 20/20 0.73
PIK3CA P42336 1/20 0.60

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
SCHEMBL12773686 0.97 MTOR (0.75) MTORPIK3CA
SCHEMBL12774566 0.93 MTOR (0.73) MTORPIK3CA
SCHEMBL7873083 0.92 MTOR (0.74) MTOR
SCHEMBL12773424 0.91 MTOR (0.75) MTOR
SCHEMBL12773003 0.91 MTOR (0.75) MTORPIK3CA
SCHEMBL12773653 0.90 MTOR (0.74) MTORPIK3CA
SCHEMBL12773441 0.90 MTOR (0.74) MTORPIK3CA
SCHEMBL7876939 0.90 MTOR (0.75) MTORPIK3CA
SCHEMBL12773456 0.90 MTOR (0.74) MTOR
SCHEMBL12773445 0.90 MTOR (0.74) MTORPIK3CA

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