SCHEMBL3847461

SCHEMBL3847461

COCCOc1ncc(C(=O)NCC(C)(O)C2CC2)cc1-c1ccc(F)cc1

nearest known ligand 0.66

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
CNR1 P21554 11/20 0.66
TACR2 P21452 1/20 0.51
ABL1 P00519 3/20 0.45
CTSA P10619 2/20 0.42
BCL9 O00512 2/20 0.41
CTNNB1 P35222 2/20 0.41
CYP2C9 P11712 2/20 0.40
MAPK14 Q16539 2/20 0.40

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
SCHEMBL1377867 1.00 CNR1 (0.66) CNR1TACR2ABL1CTSABCL9
SCHEMBL2704555 0.91 CNR1 (0.64) CNR1TACR2ABL1CYP2C9MAPK14
SCHEMBL1377750 0.91 CNR1 (0.64) CNR1TACR2ABL1CYP2C9MAPK14
SCHEMBL1377747 0.91 CNR1 (0.64) CNR1TACR2ABL1CYP2C9MAPK14
SCHEMBL1377601 0.91 CNR1 (0.80) CNR1TACR2
SCHEMBL2701999 0.89 CNR1 (0.83) CNR1BCL9CTNNB1
SCHEMBL1377202 0.89 CNR1 (0.83) CNR1BCL9CTNNB1
SCHEMBL1377491 0.89 CNR1 (0.66) CNR1TACR2CTSABCL9CTNNB1
SCHEMBL1378304 0.86 CNR1 (0.78) CNR1TACR2
SCHEMBL3845925 0.85 CNR1 (0.62) CNR1CTSABCL9CTNNB1CYP2C9

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1868999-B1 PYRIDINE-3-CARBOXAMIDE DERIVATIVES AS CB1 INVERSE AGONISTS HOFFMANN LA ROCHE (CH) 2009-07-01 EP claimed
US-7229999-B2 Pyridine-3-carboxamide derivatives as CB1 inverse agonists HOFFMANN-LA ROCHE INC. (US) 2007-06-12 US claimed
US-20060229326-A1 Pyridine-3-carboxamide derivatives as CB1 inverse agonists F. HOFFMANN-LA ROCHE AG (CH) 2006-10-12 US claimed
EP-1868999-B1 PYRIDINE-3-CARBOXAMIDE DERIVATIVES AS CB1 INVERSE AGONISTS HOFFMANN LA ROCHE (CH) 2009-07-01 EP disclosed
US-7229999-B2 Pyridine-3-carboxamide derivatives as CB1 inverse agonists HOFFMANN-LA ROCHE INC. (US) 2007-06-12 US disclosed
US-20060229326-A1 Pyridine-3-carboxamide derivatives as CB1 inverse agonists F. HOFFMANN-LA ROCHE AG (CH) 2006-10-12 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-20060229326-A1 Pyridine-3-carboxamide derivatives as CB1 inverse agonists CNR1, CNR2, GPR119 CNR1 1/4885TACR2 186/4885ABL1 1834/4885

“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.