SCHEMBL16222860

SCHEMBL16222860

COCCOC(=O)C1(OCCOC)CCC(c2nc3c(-c4ccc(-c5nccn5COCC[Si](C)(C)C)nc4)cnn3c(N(COCC[Si](C)(C)C)COCC[Si](C)(C)C)c2Br)CC1

nearest known ligand 0.34

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
▸ DGAT1 O75907 4/20 0.34

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
SCHEMBL15007384 0.90 DGAT1 (0.33) DGAT1
SCHEMBL15031453 0.90 DGAT1 (0.39) DGAT1
SCHEMBL15007529 0.89 DGAT1 (0.31) DGAT1
SCHEMBL15026300 0.89 DGAT1 (0.31) DGAT1
SCHEMBL15007530 0.89 DGAT1 (0.31) DGAT1
SCHEMBL16229240 0.88 — —
SCHEMBL16229238 0.88 MTOR (0.39) —
SCHEMBL16229239 0.88 — —
SCHEMBL15007268 0.86 DGAT1 (0.34) DGAT1
SCHEMBL16222844 0.85 DGAT1 (0.33) DGAT1

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
US-8883801-B2 Substituted pyrazolo[1,5-a]pyrimidines as mTOR inhibitors MERCK SHARP & DOHME CORP. (US) 2014-11-11 — — US disclosed
Send feedback