SCHEMBL6407030

SCHEMBL6407030

O=Nc1c2c(c3ccccc3c1N=O)CCCCC2

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HSP90AA1 P07900 1/20 0.42
PARP1 P09874 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.38
GRIA1 P42261 1/20 0.37
GRIA2 P42262 1/20 0.37
GRIA3 P42263 1/20 0.37
GRIA4 P48058 1/20 0.37
KDM4E B2RXH2 2/20 0.35
ALDH1A1 P00352 2/20 0.35
BCHE P06276 4/20 0.34
ACHE P22303 4/20 0.34
CA1 P00915 1/20 0.33
CA2 P00918 1/20 0.33
MAPK8 P45983 3/20 0.33
MAPK9 P45984 3/20 0.33
MAPK10 P53779 3/20 0.33
CSNK1D P48730 1/20 0.33
PIK3CG P48736 1/20 0.33
MKNK2 Q9HBH9 1/20 0.33
HSD17B10 Q99714 2/20 0.33

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
SCHEMBL8661416 0.73 PARP1 (0.50) PARP1SMN1; SMN2KDM4EALDH1A1BCHE
SCHEMBL8662857 0.73 PARP1 (0.50) PARP1SMN1; SMN2KDM4EALDH1A1BCHE
SCHEMBL10025575 0.71 HSP90AA1 (0.64) HSP90AA1SMN1; SMN2KDM4EALDH1A1MAPK8
SCHEMBL3898671 0.69 PARP1 (0.45) PARP1KDM4EALDH1A1BCHEACHE
SCHEMBL3458298 0.64 CDC7 (0.47) PARP1SMN1; SMN2KDM4EALDH1A1HSD17B10
SCHEMBL15968615 0.63 PARP1 (0.57) PARP1SMN1; SMN2KDM4EALDH1A1HSD17B10
SCHEMBL480352 0.61 CDC7 (0.48) PARP1KDM4EALDH1A1HSD17B10MEN1
SCHEMBL21477512 0.61 PARP1 (0.44) PARP1SMN1; SMN2KDM4EALDH1A1HSD17B10
SCHEMBL10879816 0.61 ALDH1A1 (0.46) PARP1KDM4EALDH1A1BCHEACHE
SCHEMBL31014293 0.60 PARP1 (0.96) PARP1SMN1; SMN2KDM4EALDH1A1HSD17B10

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-20050127579-A1 Process for producing molded article of reclaimed thermoplastic resin SUZUKA FUJI XEROX CO., LTD. (JP) 2005-06-16 US disclosed
EP-1479502-A1 PROCESS FOR PRODUCING MOLDED ARTICLE OF RECLAIMED THERMOPLASTIC RESIN Suzuka Fuji Xerox Co., Ltd. (JP) 2004-11-24 EP disclosed