SCHEMBL15527477

SCHEMBL15527477

O=C1CCC(=O)N1c1ccc(Br)cn1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GRIN2D O15399 1/20 0.45
GRIN3B O60391 1/20 0.45
GRIN1 Q05586 1/20 0.45
GRIN2A Q12879 1/20 0.45
GRIN2B Q13224 1/20 0.45
GRIN2C Q14957 1/20 0.45
GRIN3A Q8TCU5 1/20 0.45
NPC1 O15118 2/20 0.43
AKR1C3 P42330 1/20 0.41
RECQL P46063 1/20 0.41
ALDH1A1 P00352 5/20 0.40
KDM4E B2RXH2 3/20 0.38
MAPT P10636 1/20 0.38
SPR P35270 1/20 0.35
DDB1 Q16531 1/20 0.35
CRBN Q96SW2 1/20 0.35
PANK3 Q9H999 1/20 0.35
DPP4 P27487 1/20 0.35
G6PD P11413 1/20 0.35
RAB9A P51151 1/20 0.35

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
SCHEMBL14995793 0.78 GRIN2D (0.46) GRIN2DGRIN3BGRIN1GRIN2AGRIN2B
SCHEMBL15993947 0.77 NPC1 (0.50) NPC1RECQLALDH1A1KDM4EMAPT
SCHEMBL31202632 0.75 CNR2 (0.52) GRIN2DGRIN3BGRIN1GRIN2AGRIN2B
SCHEMBL38010 0.75 CNR2 (0.52) GRIN2DGRIN3BGRIN1GRIN2AGRIN2B
SCHEMBL15527795 0.74 RECQL (0.38) RECQL
SCHEMBL15205660 0.74 GRIN2D (0.58) GRIN2DGRIN3BGRIN1GRIN2AGRIN2B
SCHEMBL29348993 0.74 CNR2 (0.48) GRIN2DGRIN3BGRIN1GRIN2AGRIN2B
SCHEMBL18483941 0.73 GRIN2D (0.53) GRIN2DGRIN3BGRIN1GRIN2AGRIN2B
SCHEMBL28775962 0.73 CA12 (0.56) ALDH1A1MAPTGAA
SCHEMBL15527627 0.73 KDM4E (0.51) RECQLALDH1A1KDM4EPANK3

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-2014131732-A2 PLANT GROWTH REGULATING COMPOUNDS SYNGENTA PARTICIPATIONS AG (CH) 2014-09-04 WO disclosed
WO-2013164245-A1 PLANT GROWTH REGULATING COMPOUNDS SYNGENTA PARTICIPATIONS AG (CH) 2013-11-07 WO disclosed