SCHEMBL6922052

SCHEMBL6922052

CCOc1ccc(N(CC2CCCCC2)c2nc(N)nc(NCc3ccc[nH]3)n2)cc1F

nearest known ligand 0.34

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 2/20 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
SCHEMBL6428170 0.75 GALR1 (0.37) L3MBTL1
SCHEMBL5550556 0.74 GALR1 (0.49)
SCHEMBL6231024 0.74 ADORA2A (0.32)
SCHEMBL6232918 0.73 GALR1 (0.37) L3MBTL1
SCHEMBL5032177 0.73 KDM4E (0.40) L3MBTL1
SCHEMBL6864393 0.73 DRD2 (0.41)
SCHEMBL6233028 0.72 CYP19A1 (0.41)
SCHEMBL6427953 0.71 KDM4E (0.33)
SCHEMBL6016980 0.71 SMN1; SMN2 (0.38) L3MBTL1
SCHEMBL6607362 0.70 GALR1 (0.39)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2004026844-A9 METHODS AND COMPOSITIONS OF NOVEL TRIAZINE COMPOUNDS REDDY US THERAPEUTICS INC (US) 2004-11-11 WO claimed