SCHEMBL20097215

SCHEMBL20097215

COc1ccccc1-c1noc(CNCC2OC(n3cnc4c(N)ncnc43)C(OCc3ccccc3)C2OCc2ccccc2)n1

nearest known ligand 0.45

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ DOT1L Q8TEK3 4/20 0.44
▸ AHCY P23526 3/20 0.42
▸ PDE2A O00408 1/20 0.41
▸ ATM Q13315 1/20 0.40
▸ P2RX3 P56373 1/20 0.39
▸ P2RX4 Q99571 1/20 0.39
▸ P2RX2 Q9UBL9 1/20 0.39
▸ NT5E P21589 1/20 0.39
▸ ADORA1 P30542 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
SCHEMBL20096664 0.86 ATM (0.54) DOT1LAHCYATMADORA1
SCHEMBL20096666 0.78 DOT1L (0.56) DOT1LAHCYNT5EADORA1
SCHEMBL20097216 0.77 DOT1L (0.58) DOT1LAHCYP2RX3P2RX4P2RX2
SCHEMBL20096659 0.74 AHCY (0.55) DOT1LAHCYPDE2ANT5EADORA1
SCHEMBL11427985 0.74 PDE2A (0.64) DOT1LAHCYPDE2AP2RX3P2RX4
SCHEMBL5961364 0.74 PDE2A (0.64) DOT1LAHCYPDE2AP2RX3P2RX4
SCHEMBL14429057 0.72 PDE2A (0.59) DOT1LAHCYPDE2AP2RX3P2RX4
SCHEMBL20097048 0.70 AHCY (0.62) DOT1LAHCYPDE2AP2RX3P2RX4
SCHEMBL20097049 0.70 ADORA3 (0.51) DOT1LAHCYADORA1
SCHEMBL6896076 0.70 ADORA1 (0.66) DOT1LAHCYADORA1

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-20190262371-A1 METHODS AND COMPOSITION FOR THE TREATMENT OF RNA VIRAL INFECTIONS THE REGENTS OF THE UNIVERSITY OF CALIFORNIA 2019-08-29 — — US disclosed
WO-2018075947-A1 METHODS AND COMPOSITIONS FOR THE TREATMENT OF RNA VIRAL INFECTIONS THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2018-04-26 — — WO 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-20190262371-A1 METHODS AND COMPOSITION FOR THE TREATMENT OF RNA VIRAL INFECTIONS POLRMT, EIF2AK2, NSUN3 DOT1L 2274/4885AHCY 1888/4885PDE2A 3778/4885

“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.

Send feedback