SCHEMBL809619

SCHEMBL809619

C[Si](C)(C)OC1CCCc2ccccc21

nearest known ligand 0.62

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
IDO1 P14902 4/20 0.62
ADRA2A P08913 2/20 0.44
ADRA2B P18089 2/20 0.44
ADRA2C P18825 2/20 0.44
ADRA1A P35348 2/20 0.44
LMNA P02545 1/20 0.44
PDPK1 O15530 1/20 0.43
GID4 Q8IVV7 1/20 0.42
GPR84 Q9NQS5 1/20 0.42
TSHR P16473 1/20 0.42
TAS1R3 Q7RTX0 2/20 0.41
TAS1R1 Q7RTX1 2/20 0.41
TAS1R2 Q8TE23 2/20 0.41
RECQL P46063 1/20 0.41
SLC6A4 P31645 1/20 0.41

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
SCHEMBL11245122 0.83 IDO1 (0.58) IDO1ADRA2AADRA2BADRA2CADRA1A
SCHEMBL2472307 0.80 IDO1 (0.68) IDO1PDPK1GID4GPR84SLC6A4
SCHEMBL31251494 0.80 IDO1 (0.68) IDO1PDPK1GID4GPR84SLC6A4
SCHEMBL3907558 0.80 IDO1 (0.68) IDO1PDPK1GID4GPR84SLC6A4
SCHEMBL29518873 0.80 IDO1 (0.68) IDO1PDPK1GID4GPR84SLC6A4
SCHEMBL12727345 0.80 IDO1 (0.68) IDO1PDPK1GID4GPR84SLC6A4
SCHEMBL15330041 0.80 IDO1 (0.72) IDO1ADRA2AADRA1ALMNAGID4
SCHEMBL180403 0.80 IDO1 (0.72) IDO1ADRA2AADRA1ALMNAGID4
SCHEMBL13883491 0.77 IDO1 (0.54) IDO1ADRA2AADRA1ALMNAGID4
SCHEMBL17115833 0.77 IDO1 (0.68) IDO1ADRA2AADRA1ALMNAGID4

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-7968734-B2 Organocatalysts and methods of use in chemical synthesis STC.UNM (US) 2011-06-28 US disclosed
US-20070244328-A1 Organocatalysts and Methods of Use in Chemical Synthesis STC.UNM (US) 2007-10-18 US disclosed
US-20070244328-A1 Organocatalysts and Methods of Use in Chemical Synthesis STC.UNM (US) 2007-10-18 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-20070244328-A1 Organocatalysts and Methods of Use in Chemical Synthesis SCO2, CBR1, CBR3 IDO1 1355/4885ADRA2A 1952/4885ADRA2B 2385/4885

“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.