SCHEMBL600785

SCHEMBL600785

C[Si](C)(C)CCOCN(COCC[Si](C)(C)C)c1cc(CC=O)nc2ccnn12

nearest known ligand 0.32

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
CRHR1 P34998 7/20 0.32

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
SCHEMBL7886252 0.81 CRHR1 (0.33) CRHR1
SCHEMBL30278 0.80 PDE10A (0.46) CRHR1
SCHEMBL10238822 0.79 CRHR1 (0.34) CRHR1
SCHEMBL30183 0.79 CRHR1 (0.33) CRHR1
SCHEMBL10280617 0.79 CRHR1 (0.33) CRHR1
SCHEMBL597165 0.79 CRHR1 (0.31) CRHR1
SCHEMBL584441 0.78 CRHR1 (0.32) CRHR1
SCHEMBL30989 0.77 CRHR1 (0.35) CRHR1
SCHEMBL10239142 0.77 CRHR1 (0.33) CRHR1
SCHEMBL584907 0.77 CRHR1 (0.33) CRHR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2417138-A1 PYRAZOLO [1, 5-A] PYRIMIDINE DERIVATIVES AS MTOR INHIBITORS Schering Corporation (US) 2012-02-15 EP disclosed
WO-2010118207-A1 PYRAZOLO [1, 5-A] PYRIMIDINE DERIVATIVES AS MTOR INHIBITORS SCHERING CORPORATION (US) 2010-10-14 WO disclosed