SCHEMBL7968381

SCHEMBL7968381

Cc1cc(Cn2nn[nH]c2=O)no1

nearest known ligand 0.48

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
MAPT P10636 1/20 0.48
RECQL P46063 1/20 0.48
GRIN1 Q05586 15/20 0.42
GRIN2B Q13224 15/20 0.42
TLR7 Q9NYK1 1/20 0.40
GABRA5 P31644 2/20 0.39
GABRA1 P14867 1/20 0.39
FEN1 P39748 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
SCHEMBL7981346 0.71 ALDH1A1 (0.43)
SCHEMBL7979610 0.71 VHL (0.35) GRIN1GRIN2BFEN1
SCHEMBL8306630 0.70 LMNA (0.39) MAPTRECQL
SCHEMBL7985092 0.69 CNR2 (0.33) GRIN1GRIN2B
SCHEMBL13559779 0.66 AURKA (0.53) MAPTRECQL
SCHEMBL20328913 0.66 EGFR (0.52) MAPTRECQL
SCHEMBL7981612 0.66 GRIN2B (0.36) GRIN1GRIN2B
SCHEMBL20353495 0.65 MAPT (0.45) MAPTRECQL
SCHEMBL1087788 0.65 AURKA (0.51) MAPTRECQL
SCHEMBL17458923 0.65 GRIN2B (0.46) MAPTRECQLGRIN1GRIN2BTLR7

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
US-6262275-B1 AS HERBICIDES NIHON BAYER AGROCHEM K.K. (JP) 2001-07-17 US disclosed
US-6017853-A HERBICIDES; CHEMICAL INTERMEDIATES NIHON BAYER AGROCHEM K.K. (JP) 2000-01-25 US disclosed