SCHEMBL13070331

SCHEMBL13070331

CCC(=O)c1oc2nc(-c3ccccc3Cl)c(-c3ccc(Cl)cc3)cc2c1N

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
CNR1 P21554 20/20 1.00
CNR2 P34972 17/20 1.00
GABRA1 P14867 1/20 0.57
GABRB1 P18505 1/20 0.57
GABRA5 P31644 1/20 0.57
GABRA3 P34903 1/20 0.57
GABRA2 P47869 1/20 0.57
GABRB2 P47870 1/20 0.57
GABRA4 P48169 1/20 0.57
KCNH2 Q12809 1/20 0.57
GABRA6 Q16445 1/20 0.57

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
SCHEMBL5247000 0.91 CNR1 (1.00) CNR1CNR2GABRA1GABRB1GABRA5
SCHEMBL14028326 0.89 CNR1 (0.80) CNR1CNR2GABRA1GABRB1GABRA5
SCHEMBL5246914 0.87 CNR1 (0.77) CNR1CNR2GABRA1GABRB1GABRA5
SCHEMBL3402833 0.87 CNR1 (0.85) CNR1CNR2GABRA1GABRB1GABRA5
SCHEMBL1629370 0.87 CNR1 (0.77) CNR1CNR2GABRA1GABRB1GABRA5
SCHEMBL1628068 0.87 CNR1 (0.77) CNR1CNR2GABRA1GABRB1GABRA5
SCHEMBL1628616 0.86 CNR1 (1.00) CNR1CNR2GABRA1GABRB1GABRA5
SCHEMBL1628397 0.86 CNR1 (1.00) CNR1CNR2GABRA1GABRB1GABRA5
SCHEMBL13070534 0.85 CNR1 (0.74) CNR1CNR2GABRA1GABRB1GABRA5
SCHEMBL5248245 0.85 CNR1 (1.00) CNR1CNR2GABRA1GABRB1GABRA5

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
EP-2146997-B1 SUBSTITUTED FURO[2,3-B]PYRIDINE DERIVATIVES AS CANNABINOID-1 RECEPTOR MODULATORS MERCK SHARP & DOHME (US) 2010-11-10 EP disclosed
US-20080269279-A1 Substituted furo[2,3-B] pyridine derivatives as cannabinoid-1 receptor modulators MERCK SHARP & DOHME CORP. 2008-10-30 US disclosed
US-20080269279-A1 Substituted furo[2,3-B] pyridine derivatives as cannabinoid-1 receptor modulators MERCK SHARP & DOHME CORP. 2008-10-30 US disclosed
WO-2008127585-A1 SUBSTITUTED FURO[2,3-B]PYRIDINE DERIVATIVES AS CANNABINOID-1 RECEPTOR MODULATORS MERCK & CO., INC. (US) 2008-10-23 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-20080269279-A1 Substituted furo[2,3-B] pyridine derivatives as cannabinoid-1 receptor modulators CNR1, CNR2, FAAH CNR1 1/4885CNR2 2/4885GABRA1 66/4885

“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.