SCHEMBL565566

SCHEMBL565566

C[Si](C)(C)CCOCn1ccc2c1ncc1ccn([C@H]3CC[C@H](O)CC3)c12

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GRM2 Q14416 2/20 0.35
GRM7 Q14831 1/20 0.35
DGAT1 O75907 5/20 0.33
GSK3B P49841 1/20 0.33
MAPT P10636 1/20 0.33
AXL P30530 3/20 0.31
TYRO3 Q06418 3/20 0.31
MERTK Q12866 3/20 0.31
FLT3 P36888 2/20 0.31
KDM4E B2RXH2 1/20 0.30
MAPK13 O15264 1/20 0.30
PRKD3 O94806 1/20 0.30
MAP4K4 O95819 1/20 0.30
EGFR P00533 1/20 0.30
RAF1 P04049 1/20 0.30
CYP1A2 P05177 1/20 0.30
LCK P06239 1/20 0.30
CYP2D6 P10635 1/20 0.30
CYP2C9 P11712 1/20 0.30
PRKCA P17252 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
SCHEMBL566635 1.00 GRM2 (0.35) GRM2GRM7DGAT1GSK3BMAPT
SCHEMBL567231 0.88 DGAT1 (0.32) DGAT1MAPK14JAK2JAK1
SCHEMBL10099319 0.85 DGAT1 (0.31) DGAT1MAPT
SCHEMBL10099309 0.84 CHRNA7 (0.36) DGAT1
SCHEMBL630837 0.83 MTOR (0.33) JAK2JAK3JAK1
SCHEMBL10099138 0.83 JAK2 (0.33) DGAT1JAK2JAK3JAK1
SCHEMBL566925 0.83 DGAT1 (0.38) DGAT1
SCHEMBL566926 0.83 DGAT1 (0.38) DGAT1
SCHEMBL10099139 0.83 SCN9A (0.42) JAK2JAK3JAK1
SCHEMBL10099290 0.82 JAK2 (0.33) DGAT1JAK2JAK3JAK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2420502-A1 FUSED PYRROLOPYRIDINE DERIVATIVE Astellas Pharma Inc. (JP) 2012-02-22 EP disclosed
US-20120034250-A1 CONDENSED PYRROLOPYRIDINE DERIVATIVE ASTELLAS PHARMA INC. (JP) 2012-02-09 US disclosed
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 GRM2 3150/4885GRM7 2823/4885DGAT1 4419/4885

“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.