SCHEMBL3706399

SCHEMBL3706399

C[Si](C)(C)CCOCn1nc(-c2ccncc2)c2ccc(Nc3nc(N)c4oc(C5CC5)cc4n3)cc21

nearest known ligand 0.31

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
AURKB Q96GD4 2/20 0.31
PLK4 O00444 1/20 0.31
MAPK13 O15264 1/20 0.31
PDPK1 O15530 1/20 0.31
DAPK3 O43293 1/20 0.31
JAK2 O60674 1/20 0.31
ROCK2 O75116 1/20 0.31
RPS6KA5 O75582 1/20 0.31
MAP4K4 O95819 1/20 0.31
PAK4 O96013 1/20 0.31
ABL1 P00519 1/20 0.31
EGFR P00533 1/20 0.31
NTRK1 P04629 1/20 0.31
INSR P06213 1/20 0.31
LCK P06239 1/20 0.31
FYN P06241 1/20 0.31
CDK1 P06493 1/20 0.31
FES P07332 1/20 0.31
CSF1R P07333 1/20 0.31
LYN P07948 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
SCHEMBL3706403 0.85
SCHEMBL3707536 0.81 SYK (0.30) SYK
SCHEMBL3701383 0.80 PDE4D (0.30)
SCHEMBL15304364 0.70 NAMPT (0.43) EGFRCSNK1D
SCHEMBL30084198 0.69 MAPT (0.37) AXL
SCHEMBL3707537 0.68 SYK (0.30) SYK
SCHEMBL30084147 0.68 NPC1 (0.34)
SCHEMBL3515565 0.68 NPC1 (0.34)
SCHEMBL3708762 0.67 DGAT1 (0.32) SYK
SCHEMBL3704193 0.66 L3MBTL1 (0.39) MAPK13SRCKDRMAPK12

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
US-8551981-B2 Furo[3,2-d]pyrimidine compounds ABBVIE INC. (US) 2013-10-08 US disclosed
US-20120122846-A1 FURO[3,2-d]PYRIMIDINE COMPOUNDS ABBOTT LABORATORIES (US) 2012-05-17 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-20120122846-A1 FURO[3,2-d]PYRIMIDINE COMPOUNDS CDK2, DPYD, CDK3 AURKB 282/4885PLK4 124/4885MAPK13 178/4885

“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.