SCHEMBL2087196

SCHEMBL2087196

CNC(=O)Nc1cc(C(=O)NC)cc(N)n1

nearest known ligand 0.39

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
PLAU P00749 1/20 0.37
MAPT P10636 1/20 0.36
FBP1 P09467 3/20 0.35
BRD4 O60885 1/20 0.35
MAP4K1 Q92918 2/20 0.35
SMN1; SMN2 Q16637 3/20 0.35
PLK1 P53350 1/20 0.35
GCK P35557 1/20 0.35
F2 P00734 1/20 0.35
F10 P00742 1/20 0.35
HDAC8 Q9BY41 2/20 0.34
HDAC6 Q9UBN7 2/20 0.34
ALDH1A1 P00352 1/20 0.34
RECQL P46063 1/20 0.34
HDAC2 Q92769 1/20 0.34

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
SCHEMBL2087730 0.87 FBP1 (0.38) MAPTFBP1BRD4MAP4K1SMN1; SMN2
SCHEMBL2088235 0.82 PLAU (0.46) PLAUBRD4SMN1; SMN2PLK1F2
SCHEMBL2088829 0.82 F10 (0.35) PLAUMAPTFBP1MAP4K1SMN1; SMN2
SCHEMBL2089275 0.80 NPC1 (0.46) MAPTSMN1; SMN2ALDH1A1
SCHEMBL2088000 0.79 FBP1 (0.48) MAPTFBP1MAP4K1SMN1; SMN2GCK
SCHEMBL2089387 0.76 FBP1 (0.52) MAPTFBP1SMN1; SMN2GCK
SCHEMBL2087527 0.76 SMN1; SMN2 (0.40) MAP4K1SMN1; SMN2ALDH1A1
SCHEMBL2088872 0.76 FBP1 (0.50) MAPTFBP1MAP4K1SMN1; SMN2PLK1
SCHEMBL2089680 0.75 KMT2A (0.40) MAPTFBP1MAP4K1SMN1; SMN2GCK
SCHEMBL2089364 0.74 MAP4K1 (0.36) MAPTFBP1MAP4K1SMN1; SMN2GCK

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-8163778-B2 Pyridines as FBPase inhibitors for treatment of diabetes HOFFMANN-LA ROCHE INC. (US) 2012-04-24 US disclosed
EP-2227452-A2 PYRIDINE COMPOUNDS F. Hoffmann-La Roche AG (CH) 2010-09-15 EP disclosed
WO-2009068468-A2 PYRIDINE COMPOUNDS F. HOFFMANN-LA ROCHE AG (CH) 2009-06-04 WO disclosed
US-20090143439-A1 NEW PYRIDINES AS FBPASE INHIBITORS FOR TREATMENT OF DIABETES HOFFMANN-LA ROCHE, INC. 2009-06-04 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-20090143439-A1 NEW PYRIDINES AS FBPASE INHIBITORS FOR TREATMENT OF DIABETES FBP1, PDXK, G6PC1 PLAU 1521/4885MAPT 2224/4885FBP1 1/4885

“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.