SCHEMBL4772383

SCHEMBL4772383

Cc1cc(-c2cncc(F)c2)cc(C(=O)O)n1

nearest known ligand 0.45

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
HCAR2 Q8TDS4 1/20 0.45
CYP11B2 P19099 7/20 0.40
PIK3CG P48736 1/20 0.39
CYP1A2 P05177 4/20 0.38
CYP2C9 P11712 4/20 0.38
CYP3A4 P08684 4/20 0.38
SLC6A3 Q01959 1/20 0.38
CYP11B1 P15538 2/20 0.38
XIAP P98170 1/20 0.37
BIRC2 Q13490 1/20 0.37
ABL1 P00519 1/20 0.36

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
SCHEMBL31031756 1.00 HCAR2 (0.45) HCAR2CYP11B2PIK3CGCYP1A2CYP2C9
SCHEMBL4777388 0.85 GRM5 (0.44)
SCHEMBL4778161 0.84 HCAR2 (0.47) HCAR2CYP11B2PIK3CGCYP11B1
SCHEMBL1797998 0.82 CYP1A2 (0.41) CYP11B2CYP1A2CYP2C9CYP3A4SLC6A3
SCHEMBL4777507 0.81 CYP11B2 (0.42) CYP11B2CYP11B1
SCHEMBL4779431 0.81 HCAR2 (0.39) HCAR2CYP1A2CYP2C9
SCHEMBL1792907 0.81 CYP1A2 (0.48) CYP1A2CYP2C9CYP3A4SLC6A3XIAP
SCHEMBL4772052 0.80 ALOX15 (0.46) HCAR2
SCHEMBL4772296 0.80 SCN9A (0.51)
SCHEMBL4772437 0.79 MKNK1 (0.49) CYP11B2PIK3CGCYP1A2CYP2C9CYP3A4

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-1987003-A1 PYRIDINE-2-CARBOXAMIDE DERIVATIVES F.HOFFMANN-LA ROCHE AG (CH) 2008-11-05 EP claimed
WO-2007093542-A1 PYRIDINE-2-CARBOXAMIDE DERIVATIVES F. HOFFMANN-LA ROCHE AG (CH) 2007-08-23 WO claimed
US-20070197553-A1 4-Aryl-pyridine-2-carboxyamide derivatives HOFFMANN-LA ROCHE INC. 2007-08-23 US claimed
EP-1987003-A1 PYRIDINE-2-CARBOXAMIDE DERIVATIVES F.HOFFMANN-LA ROCHE AG (CH) 2008-11-05 EP disclosed
WO-2007093542-A1 PYRIDINE-2-CARBOXAMIDE DERIVATIVES F. HOFFMANN-LA ROCHE AG (CH) 2007-08-23 WO disclosed
US-20070197553-A1 4-Aryl-pyridine-2-carboxyamide derivatives HOFFMANN-LA ROCHE INC. 2007-08-23 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-20070197553-A1 4-Aryl-pyridine-2-carboxyamide derivatives GRM2, GRM1, GRM3 HCAR2 55/4885CYP11B2 2896/4885PIK3CG 2974/4885

“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.