SCHEMBL584835

SCHEMBL584835

C[Si](C)(C)CCOCn1cc(C2CCC3(CCCO3)CC2)cn1

nearest known ligand 0.31

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ GPR119 Q8TDV5 2/20 0.31
▸ DGAT1 O75907 1/20 0.30

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
SCHEMBL2679694 0.86 DGAT1 (0.31) DGAT1
SCHEMBL20299094 0.84 DGAT1 (0.34) DGAT1
SCHEMBL25287756 0.84 DGAT1 (0.37) DGAT1
SCHEMBL584369 0.78 KLKB1 (0.35) DGAT1
SCHEMBL27042148 0.71 KLKB1 (0.31) DGAT1
SCHEMBL27042261 0.71 KLKB1 (0.33) —
SCHEMBL15564816 0.70 DGAT1 (0.35) DGAT1
SCHEMBL29260329 0.69 DGAT1 (0.31) DGAT1
SCHEMBL31501754 0.69 ATR (0.34) DGAT1
SCHEMBL17610630 0.68 ALDH1A1 (0.40) —

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
Send feedback