SCHEMBL20305017

SCHEMBL20305017

O=C(Nc1ccccc1F)N1CCN(c2ncnc3c2nc(-c2ccccc2Cl)n3-c2ccc(Cl)cc2)CC1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
CNR1 P21554 20/20 1.00
CNR2 P34972 15/20 1.00

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
SCHEMBL20304613 0.93 CNR1 (1.00) CNR1CNR2
SCHEMBL20304787 0.90 CNR1 (1.00) CNR1CNR2
SCHEMBL20304822 0.89 CNR1 (1.00) CNR1CNR2
SCHEMBL20304775 0.89 CNR1 (1.00) CNR1CNR2
SCHEMBL20304769 0.87 CNR1 (1.00) CNR1CNR2
SCHEMBL20304767 0.85 CNR1 (1.00) CNR1CNR2
SCHEMBL21578817 0.85 CNR1 (0.82) CNR1CNR2
SCHEMBL20304708 0.85 CNR1 (0.82) CNR1CNR2
SCHEMBL20304682 0.84 CNR1 (0.81) CNR1CNR2
SCHEMBL21578816 0.84 CNR1 (0.77) CNR1CNR2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10696677-B2 Diaryl purine derivatives with improved bioavailability RESEARCH TRIANGLE INSTITUTE (US) 2020-06-30 US disclosed
US-20190352305-A1 DIARYL PURINE DERIVATIVES WITH IMPROVED BIOAVAILABILITY NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT 2019-11-21 US disclosed
EP-3558996-A1 DIARYL PURINE DERIVATIVES WITH IMPROVED BIOAVAILABILITY Research Triangle Institute, International (US) 2019-10-30 EP disclosed
WO-2018119076-A1 DIARYL PURINE DERIVATIVES WITH IMPROVED BIOAVAILABILITY RESEARCH TRIANGLE INSTITUTE (US) 2018-06-28 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 (2 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-10696677-B2 Diaryl purine derivatives with improved bioavailability CNR1, CNR2, GPR119 CNR1 1/4885CNR2 2/4885
US-20190352305-A1 DIARYL PURINE DERIVATIVES WITH IMPROVED BIOAVAILABILITY CNR1, CNR2, GPR119 CNR1 1/4885CNR2 2/4885

“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.