SCHEMBL20906508

SCHEMBL20906508

CN(C(=O)O)C(=O)c1ccc2c(c1)CCOC2CCO

nearest known ligand 0.43

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
HTR1D P28221 18/20 0.43
DRD2 P14416 5/20 0.43
HTR2A P28223 5/20 0.43
HTR1A P08908 5/20 0.43
DRD4 P21917 2/20 0.43
HTR1B P28222 9/20 0.41
SLC6A4 P31645 4/20 0.39
MEN1 O00255 1/20 0.39
MAPT P10636 1/20 0.39
KMT2A Q03164 1/20 0.39
KDM4C Q9H3R0 1/20 0.39

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
SCHEMBL6808728 0.89 HTR1D (0.45) HTR1DDRD2HTR2AHTR1ADRD4
SCHEMBL20921241 0.85 HTR1D (0.41) HTR1DDRD2HTR2AHTR1ADRD4
SCHEMBL20921215 0.85 HTR1D (0.41) HTR1DDRD2HTR2AHTR1ADRD4
SCHEMBL8550172 0.84 HTR1D (0.46) HTR1DDRD2HTR2AHTR1ADRD4
SCHEMBL8551173 0.82 HTR1D (0.41) HTR1DDRD2HTR2AHTR1ADRD4
SCHEMBL6812048 0.81 HTR1D (0.56) HTR1DDRD2HTR2AHTR1ADRD4
SCHEMBL5093578 0.81 HTR1D (0.56) HTR1DDRD2HTR2AHTR1ADRD4
SCHEMBL8549578 0.80 HTR1D (0.62) HTR1DDRD2HTR2AHTR1ADRD4
SCHEMBL6811442 0.76 HTR1D (0.42) HTR1DDRD2HTR2AHTR1ADRD4
SCHEMBL6811669 0.76 HTR1D (0.42) HTR1DDRD2HTR2AHTR1ADRD4

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-10266503-B1 Sulfoxide ligand metal catalyzed oxidation of olefins THE BOARD OF TRUSTEES OF THE UNIVERSITY OF ILLINOIS (US) 2019-04-23 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-10266503-B1 Sulfoxide ligand metal catalyzed oxidation of olefins YAP1, ICOSLG, SPIN3 HTR1D 840/4885DRD2 813/4885HTR2A 617/4885

“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.