SCHEMBL6809472

SCHEMBL6809472

CC(C)(C)[Si](C)(C)OCC[C@@H]1OCCc2c1ccc(O)c2Cl

nearest known ligand 0.43

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
DRD1 P21728 4/20 0.43
ADRA2A P08913 3/20 0.32
ADRA2B P18089 3/20 0.32
ADRA2C P18825 3/20 0.32
ADRA1D P25100 3/20 0.32
ADRA1A P35348 3/20 0.32
ADRA1B P35368 3/20 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
SCHEMBL6811434 0.84 HTR2A (0.33) DRD1
SCHEMBL6808310 0.79 ESR1 (0.36)
SCHEMBL6808209 0.78 DRD2 (0.36) DRD1
SCHEMBL6808207 0.78 DRD2 (0.36) DRD1
SCHEMBL6551574 0.72 KEAP1 (0.54) ADRA2AADRA2BADRA2C
SCHEMBL5092368 0.71 HTR1D (0.36)
SCHEMBL6811491 0.71 HTR1D (0.34)
SCHEMBL5092141 0.71 HTR1D (0.34)
SCHEMBL6812077 0.70 HTR1D (0.43)
SCHEMBL5097946 0.70 HTR1D (0.43)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20040122001-A1 Pharmaceutical compounds ELI LILLY AND COMPANY 2004-06-24 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-20040122001-A1 Pharmaceutical compounds CYP2D6, LPXN, CYP1B1 DRD1 532/4885ADRA2A 492/4885ADRA2B 475/4885

“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.