SCHEMBL2152840

SCHEMBL2152840

CCNC(=O)Oc1ccc(-c2nc(C(=O)O)c(OCC)c(N3CCOCC3)n2)cc1

nearest known ligand 0.62

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
MTOR P42345 20/20 0.62

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
SCHEMBL2148791 0.91 MTOR (0.75) MTOR
SCHEMBL18156607 0.89 MTOR (0.69) MTOR
SCHEMBL2181854 0.87 MTOR (0.69) MTOR
SCHEMBL18142939 0.85 MTOR (0.84) MTOR
SCHEMBL13718899 0.81 MTOR (0.56) MTOR
SCHEMBL13718507 0.81 MTOR (0.81) MTOR
SCHEMBL2148703 0.81 MTOR (0.85) MTOR
SCHEMBL18142956 0.81 MTOR (0.73) MTOR
SCHEMBL17747079 0.81 MTOR (0.76) MTOR
SCHEMBL18142963 0.81 MTOR (0.83) 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 4 patents. 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 claimed
EP-2519102-B1 NOVEL PYRIMIDINE COMPOUNDS AS mTOR AND PI3K INHIBITORS DEV CENTER BIOTECHNOLOGY (TW) 2016-10-19 EP disclosed
EP-2519102-A2 NOVEL PYRIMIDINE COMPOUNDS AS mTOR AND PI3K INHIBITORS Development Center For Biotechnology (TW) 2012-11-07 EP disclosed
WO-2011080568-A2 NOVEL PYRIMIDINE COMPOUNDS AS MTOR AND P13K INHIBITORS DEVELOPMENT CENTER FOR BIOTECHNOLOGY (TW) 2011-07-07 WO disclosed