SCHEMBL19971751

SCHEMBL19971751

C[Si](C)(C)c1cc(-c2ccccc2)ccc1OS(=O)(=O)C(F)(F)F

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTPN1 P18031 4/20 0.39
ACLY P53396 6/20 0.37
ADORA2A P29274 1/20 0.36
ADORA1 P30542 1/20 0.36
ALPL P05186 1/20 0.35
CA1 P00915 1/20 0.35
CA2 P00918 1/20 0.35
CA9 Q16790 1/20 0.35
PTPN5 P54829 3/20 0.35
PDE4A P27815 1/20 0.33
PDE4C Q08493 1/20 0.33
PDE4D Q08499 1/20 0.33
KIF11 P52732 1/20 0.33
MEN1 O00255 1/20 0.33
S1PR4 O95977 1/20 0.33
LMNA P02545 1/20 0.33
TP53 P04637 1/20 0.33
POLB P06746 1/20 0.33
HPGD P15428 1/20 0.33
S1PR1 P21453 1/20 0.33

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
SCHEMBL17048114 0.82 EPAS1 (0.37) CA1CA2
SCHEMBL29607374 0.82 DRD2 (0.40) ADORA2AADORA1
SCHEMBL1713611 0.82 DRD2 (0.40) ADORA2AADORA1
SCHEMBL12381189 0.81 CA1 (0.40) CA1CA2CA9KMT2A
SCHEMBL28142221 0.80 DRD2 (0.39) ADORA2AADORA1
SCHEMBL25353653 0.79 ALPL (0.36) ALPLCA1CA2
SCHEMBL4370623 0.79 EPAS1 (0.38) ADORA2AADORA1ALPLPDE4APDE4C
SCHEMBL14985330 0.79 HSD11B1 (0.38) ADORA2AADORA1CA1CA2CA9
SCHEMBL30387806 0.79 HSD11B1 (0.38) ADORA2AADORA1CA1CA2CA9
SCHEMBL29458425 0.79 SLC6A9 (0.44) PTPN1ACLYADORA2AADORA1CA1

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20180083203-A1 ORGANIC ELECTROLUMINESCENT MATERIALS AND DEVICES UNIVERSAL DISPLAY CORPORATION 2018-03-22 US disclosed
US-20180083203-A1 ORGANIC ELECTROLUMINESCENT MATERIALS AND DEVICES UNIVERSAL DISPLAY CORPORATION 2018-03-22 US disclosed
US-20180083203-A1 ORGANIC ELECTROLUMINESCENT MATERIALS AND DEVICES UNIVERSAL DISPLAY CORPORATION 2018-03-22 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-20180083203-A1 ORGANIC ELECTROLUMINESCENT MATERIALS AND DEVICES NES, CACNA2D4, PGLS PTPN1 2347/4885ACLY 2643/4885ADORA2A 1197/4885

“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.