SCHEMBL4074488

SCHEMBL4074488

C[Si](C)(C)CCOCn1cc(C2C=CCC2)c2cc(F)c(F)cc2c1=O

nearest known ligand 0.31

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
EGFR P00533 1/20 0.31
IGF1R P08069 1/20 0.31
SRC P12931 1/20 0.31
FLT4 P35916 1/20 0.31
KDR P35968 1/20 0.31
FLT3 P36888 1/20 0.31
EPHB4 P54760 1/20 0.31
TEK Q02763 1/20 0.31
KLKB1 P03952 1/20 0.31
NPC1 O15118 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
SCHEMBL3311699 0.76 NPC1 (0.35) EGFRIGF1RSRCFLT4KDR
SCHEMBL23124318 0.69 DGAT1 (0.33)
SCHEMBL10479182 0.63 KMT2A (0.40) EGFRIGF1RSRCFLT4KDR
SCHEMBL31564640 0.62 DGAT1 (0.36) EGFRIGF1RSRCFLT4KDR
SCHEMBL30319360 0.62 NPC1 (0.38) NPC1
SCHEMBL10479252 0.62 LMNA (0.44)
SCHEMBL3308032 0.62 IDO1 (0.36)
SCHEMBL17980997 0.62 NPC1 (0.41) EGFRIGF1RSRCFLT4KDR
SCHEMBL25697650 0.61 DGAT1 (0.41) EGFRIGF1RSRCFLT4KDR
SCHEMBL17362771 0.61 DGAT1 (0.40) EGFRIGF1RSRCFLT4KDR

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-20100113391-A1 BICYCLIC HETEROCYCLIC COMPOUND ASTELLAS PHARMA INC. (JP) 2010-05-06 US disclosed
EP-2138482-A1 BICYCLIC HETEROCYCLIC COMPOUND Astellas Pharma Inc. (JP) 2009-12-30 EP 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-20100113391-A1 BICYCLIC HETEROCYCLIC COMPOUND P2RY12, P2RY4, P2RY1 EGFR 3600/4885IGF1R 1506/4885SRC 1044/4885

“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.