SCHEMBL7253179

SCHEMBL7253179

CCC(F)C1=Nc2ccccc2[N]1

nearest known ligand 0.30

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.30
GAA P10253 1/20 0.30

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
SCHEMBL5603763 0.78 TSHR (0.39)
SCHEMBL908901 0.77
SCHEMBL908377 0.77
SCHEMBL5600868 0.74 MAPT (0.32) KDM4EGAA
SCHEMBL5600756 0.69 POLB (0.33)
SCHEMBL5601257 0.68 ALDH1A1 (0.33)
SCHEMBL5601434 0.67 CSNK1E (0.35) KDM4E
SCHEMBL5601440 0.67 CSNK1E (0.35) KDM4E
SCHEMBL5603832 0.67 CSNK1E (0.35) KDM4E
SCHEMBL5602687 0.67 CSNK1E (0.35) KDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2003053941-A2 BARBITURIC ACID DERIVATIVES AS INHIBITORS OF TNF-ALPHA CONVERTING ENZYME (TACE) AND/OR MATRIX METALLOPROTEINASES BRISTOL-MYERS SQUIBB COMPANY (US) 2003-07-03 WO disclosed
WO-2003040103-A1 β-SULFONE DERIVATIVES AS INHIBITORS OF MATRIX METALLOPROTEINASES AND/OR TNF-α CONVERTING ENZYME (TACE) BRISTOL-MYERS SQUIBB COMPANY (US) 2003-05-15 WO disclosed