SCHEMBL279114

SCHEMBL279114

C=C(/N=C/c1cc(Br)ccc1Oc1cccc(C#N)c1)O[Si](C)(C)C

nearest known ligand 0.42

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
CCR5 P51681 2/20 0.42
EPAS1 Q99814 8/20 0.39
VEGFA P15692 4/20 0.37
AR P10275 1/20 0.35
HPGD P15428 2/20 0.33
PDE4A P27815 1/20 0.33
PDE4B Q07343 1/20 0.33
PDE4C Q08493 1/20 0.33
PDE4D Q08499 1/20 0.33
TSHR P16473 1/20 0.33
CYP19A1 P11511 1/20 0.32
SLC6A4 P31645 1/20 0.32
MAP4K4 O95819 1/20 0.32

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
SCHEMBL279190 0.80 CCR5 (0.43) CCR5HPGDTSHR
SCHEMBL279202 0.79 HPGD (0.36) CCR5HPGDTSHR
SCHEMBL279339 0.79 LMNA (0.40) CCR5HPGDTSHR
SCHEMBL275612 0.76 TBXA2R (0.38) ARPDE4APDE4BPDE4CPDE4D
SCHEMBL278967 0.76 TBXA2R (0.38) ARPDE4APDE4BPDE4CPDE4D
SCHEMBL279350 0.76 TBXA2R (0.36) CCR5ARHPGDTSHRCYP19A1
SCHEMBL279205 0.76 TBXA2R (0.36) ARPDE4APDE4BPDE4CPDE4D
SCHEMBL279344 0.76 SLC6A4 (0.46) HPGDTSHRSLC6A4
SCHEMBL278988 0.75 CCR5 (0.45) CCR5HPGD
SCHEMBL276480 0.74 EPAS1 (0.49) CCR5EPAS1VEGFAARCYP19A1

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 CCR5 2331/4885EPAS1 2981/4885VEGFA 2013/4885

“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.