SCHEMBL4133349

SCHEMBL4133349

COCOc1cc(OCC2CC2)c(C(O[SiH](c2ccccc2)c2ccccc2)C(C)(C)C)cc1C(C)=O

nearest known ligand 0.35

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
EGFR P00533 1/20 0.35
RIPK1 Q13546 1/20 0.33
IRAK4 Q9NWZ3 3/20 0.33
NR1H4 Q96RI1 1/20 0.32
CYP3A4 P08684 1/20 0.32
TSHR P16473 1/20 0.32
PDE4B Q07343 3/20 0.32
PDE4A P27815 2/20 0.32
PDE4C Q08493 2/20 0.32
PDE4D Q08499 2/20 0.32
RBP4 P02753 1/20 0.32
FFAR1 O14842 3/20 0.31
SRC P12931 1/20 0.31
CNR2 P34972 1/20 0.31
S1PR2 O95136 1/20 0.31
KCNH2 Q12809 1/20 0.31
ACACB O00763 1/20 0.31
ACACA Q13085 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
SCHEMBL4114636 0.87 RIPK1 (0.35) RIPK1IRAK4PDE4BPDE4APDE4C
SCHEMBL4127151 0.79 RIPK1 (0.34) RIPK1PDE4B
SCHEMBL4127161 0.79 RIPK1 (0.34) RIPK1PDE4B
SCHEMBL4133338 0.73 NR1H4 (0.39) RIPK1NR1H4CYP3A4PDE4BPDE4A
SCHEMBL4115194 0.72 BRD4 (0.33) RIPK1CYP3A4PDE4BCNR2KCNH2
SCHEMBL14930787 0.67 CYP3A4 (0.51) EGFRCYP3A4TSHR
SCHEMBL10349585 0.65 ALDH1A1 (0.39) TSHR
SCHEMBL23202755 0.64 CYP3A4 (0.67) EGFRCYP3A4TSHR
SCHEMBL30350318 0.64 CYP3A4 (0.67) EGFRCYP3A4TSHR
SCHEMBL2509816 0.63 MEN1 (0.33)

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-20090318690-A1 Benzisoxazole Compound EISAI R&D MANAGEMENT CO., LTD. (JP) 2009-12-24 US disclosed
EP-2017275-A1 BENZISOXAZOLE COMPOUND Eisai R&D Management Co., Ltd. (JP) 2009-01-21 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-20090318690-A1 Benzisoxazole Compound NR1I2, NR1I3, NR0B1 EGFR 1992/4885RIPK1 3129/4885IRAK4 1514/4885

“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.