SCHEMBL18156593

SCHEMBL18156593

COc1cnc(-c2ccc(NC(=O)Nc3ccc(C)cc3)cc2)nc1N1CCOCC1

nearest known ligand 0.87

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
MTOR P42345 20/20 0.87

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
SCHEMBL2148792 0.93 MTOR (1.00) MTOR
SCHEMBL2153327 0.92 MTOR (1.00) MTOR
SCHEMBL2148596 0.91 MTOR (1.00) MTOR
SCHEMBL13718210 0.91 MTOR (1.00) MTOR
SCHEMBL2154546 0.91 MTOR (0.85) MTOR
SCHEMBL2148708 0.91 MTOR (1.00) MTOR
SCHEMBL2152844 0.91 MTOR (1.00) MTOR
SCHEMBL2153931 0.90 MTOR (1.00) MTOR
SCHEMBL2152847 0.90 MTOR (0.84) MTOR
SCHEMBL2153568 0.89 MTOR (1.00) 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
EP-2519102-B1 NOVEL PYRIMIDINE COMPOUNDS AS mTOR AND PI3K INHIBITORS DEV CENTER BIOTECHNOLOGY (TW) 2016-10-19 EP disclosed