SCHEMBL279205

SCHEMBL279205

C=C(/N=C/c1cc(I)ccc1Oc1ccc(C#N)cc1)O[Si](C)(C)C

nearest known ligand 0.36

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
TBXA2R P21731 3/20 0.36
AR P10275 1/20 0.34
CYP11B1 P15538 4/20 0.31
CYP11B2 P19099 3/20 0.31
SLC6A4 P31645 1/20 0.31
ICAM1 P05362 2/20 0.31
SELE P16581 2/20 0.31
VCAM1 P19320 2/20 0.31
ESRRA P11474 1/20 0.31
PDE4A P27815 1/20 0.31
PDE4B Q07343 1/20 0.31
PDE4C Q08493 1/20 0.31
PDE4D Q08499 1/20 0.31
SCN9A Q15858 4/20 0.31
CCNC P24863 1/20 0.30
CDK8 P49336 1/20 0.30
PLA2G7 Q13093 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
SCHEMBL275612 0.87 TBXA2R (0.38) TBXA2RARCYP11B1SLC6A4ICAM1
SCHEMBL278967 0.87 TBXA2R (0.38) TBXA2RARCYP11B1SLC6A4ICAM1
SCHEMBL279350 0.87 TBXA2R (0.36) TBXA2RARCYP11B1CYP11B2SLC6A4
SCHEMBL278919 0.87 LMNA (0.40)
SCHEMBL278922 0.81 MAPT (0.32)
SCHEMBL279335 0.81 CA1 (0.36)
SCHEMBL279098 0.79
SCHEMBL279114 0.76 CCR5 (0.42) ARSLC6A4PDE4APDE4BPDE4C
SCHEMBL279179 0.76 LMNA (0.44) SLC6A4SCN9A
SCHEMBL275677 0.76 LMNA (0.44) SLC6A4SCN9A

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-8134001-B2 Spiroindolinone derivatives HOFFMANN-LA ROCHE INC. (US) 2012-03-13 US disclosed
US-20090156610-A1 Spiroindolinone Derivatives DING QINGJIE 2009-06-18 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-20090156610-A1 Spiroindolinone Derivatives SDHA, AR, XPOT TBXA2R 236/4885AR 2/4885CYP11B1 234/4885

“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.