SCHEMBL3489877

SCHEMBL3489877

COc1cccnc1-c1nn(COCC[Si](C)(C)C)c2ncc(Br)cc12

nearest known ligand 0.36

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
DGAT1 O75907 4/20 0.36
AKT1 P31749 1/20 0.34
EGFR P00533 1/20 0.33
IGF1R P08069 1/20 0.33
SRC P12931 1/20 0.33
FLT4 P35916 1/20 0.33
KDR P35968 1/20 0.33
FLT3 P36888 1/20 0.33
EPHB4 P54760 1/20 0.33
TEK Q02763 1/20 0.33
MAOB P27338 1/20 0.31
PDE10A Q9Y233 1/20 0.31
PDE1B Q01064 1/20 0.31
ALOX5AP P20292 1/20 0.30
GSK3B P49841 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
SCHEMBL3375894 0.87 DGAT1 (0.40) DGAT1AKT1EGFRIGF1RSRC
SCHEMBL29930779 0.82 AXL (0.41) DGAT1SRCFLT4KDRFLT3
SCHEMBL1592834 0.81 MERTK (0.39) DGAT1IGF1RFLT4KDRFLT3
SCHEMBL29930401 0.81 DYRK1B (0.40) DGAT1SRCKDRFLT3PDE1B
SCHEMBL29930815 0.80 AXL (0.41) DGAT1EGFRSRCKDREPHB4
SCHEMBL3490706 0.79 AKT1 (0.33) AKT1MAOBPDE1BALOX5AP
SCHEMBL27193468 0.79 DGAT1 (0.37) DGAT1PDE1BGSK3B
SCHEMBL29930809 0.79 DGAT1 (0.37) DGAT1SRCKDRFLT3
SCHEMBL3490473 0.78 DGAT1 (0.42) DGAT1PDE10AALOX5AP
SCHEMBL3490212 0.78 DGAT1 (0.38) DGAT1EGFRALOX5APGSK3B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8268994-B2 Fused ring heterocycle kinase modulators SGX PHARMACEUTICALS, INC. (US) 2012-09-18 US disclosed
US-20100036118-A1 Fused Ring Heterocycle Kinase Modulators SGX PHARMACEUTICALS, INC. 2010-02-11 US disclosed
EP-2134179-A1 FUSED RING HETEROCYCLE KINASE MODULATORS SGX Pharmaceuticals, Inc. (US) 2009-12-23 EP disclosed
US-7626021-B2 Fused ring heterocycle kinase modulators SGX PHARMACEUTICALS, INC. (US) 2009-12-01 US disclosed
WO-2008124850-A1 FUSED RING HETEROCYCLE KINASE MODULATORS SGX PHARMACEUTICALS, INC. (US) 2008-10-16 WO disclosed
US-20070287711-A1 FUSED RING HETEROCYCLE KINASE MODULATORS SGX PHARMACEUTICALS, INC. (US) 2007-12-13 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (2 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20070287711-A1 FUSED RING HETEROCYCLE KINASE MODULATORS MAP3K20, TTK, MAP3K19 DGAT1 3371/4885AKT1 148/4885EGFR 574/4885
US-20100036118-A1 Fused Ring Heterocycle Kinase Modulators MAP3K20, TTK, MAP3K19 DGAT1 3371/4885AKT1 148/4885EGFR 574/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.