SCHEMBL10099308

SCHEMBL10099308

C[Si](C)(C)CCOCn1ccc2c(N)c(C=O)cnc21

nearest known ligand 0.34

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
DGAT1 O75907 3/20 0.34
NPC1 O15118 1/20 0.33
MAPT P10636 1/20 0.32
BRD4 O60885 1/20 0.31
CREBBP Q92793 1/20 0.31

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
SCHEMBL2288363 0.86 DGAT1 (0.35) DGAT1NPC1MAPTBRD4CREBBP
SCHEMBL29825101 0.86 DGAT1 (0.35) DGAT1NPC1MAPTBRD4CREBBP
SCHEMBL2290099 0.85 EGFR (0.34) DGAT1NPC1MAPTBRD4CREBBP
SCHEMBL22620183 0.82 DGAT1 (0.40) DGAT1NPC1MAPTBRD4CREBBP
SCHEMBL2287470 0.81 DGAT1 (0.31) DGAT1MAPT
SCHEMBL566964 0.79 KDM4E (0.34) DGAT1NPC1MAPT
SCHEMBL25285605 0.78 MAPT (0.30) MAPT
SCHEMBL14697439 0.78 PDE4B (0.35) DGAT1MAPTBRD4CREBBP
SCHEMBL30478940 0.78 MAPT (0.30) MAPT
SCHEMBL10099303 0.77 JAK2 (0.32) MAPTBRD4CREBBP

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-20120034250-A1 CONDENSED PYRROLOPYRIDINE DERIVATIVE ASTELLAS PHARMA INC. (JP) 2012-02-09 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 (1 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-20120034250-A1 CONDENSED PYRROLOPYRIDINE DERIVATIVE JAK2, JAK1, JAK3 DGAT1 4419/4885NPC1 3590/4885MAPT 3074/4885

“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.