SCHEMBL8953418

SCHEMBL8953418

O=C(OC1=NCCN1)c1cc2ccccc2[nH]1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 3/20 0.50
PTPN2 P17706 2/20 0.50
PTPN1 P18031 2/20 0.50
LMNA P02545 1/20 0.50
TP53 P04637 1/20 0.50
L3MBTL1 Q9Y468 1/20 0.50
FLT3 P36888 1/20 0.49
MAPT P10636 1/20 0.48
DAO P14920 1/20 0.48
HPGD P15428 1/20 0.48
SRD5A2 P31213 1/20 0.48
HSD17B10 Q99714 1/20 0.48
HRH4 Q9H3N8 1/20 0.45
HRH3 Q9Y5N1 1/20 0.45
MAP2K1 Q02750 1/20 0.44
ALDH1A1 P00352 1/20 0.43
GAA P10253 1/20 0.43
MAPK1 P28482 1/20 0.43
PDGFRB P09619 4/20 0.43
PDGFRA P16234 4/20 0.43

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
SCHEMBL8953381 0.76 XDH (0.43) KDM4ELMNAMAPTHRH4MAP2K1
SCHEMBL9208032 0.74 CYP3A4 (0.47) KDM4ELMNAMAPTALDH1A1MAOB
SCHEMBL28304567 0.74 KDM4E (0.64) KDM4EPTPN2PTPN1LMNATP53
SCHEMBL31561461 0.74 FLT3 (0.61) KDM4EPTPN2PTPN1LMNATP53
SCHEMBL9491122 0.74 MAPT (0.51) KDM4ELMNATP53L3MBTL1FLT3
SCHEMBL9493033 0.73 BCL2L1 (0.47) KDM4ELMNAL3MBTL1HPGDHRH4
SCHEMBL8953614 0.71 KDM4E (0.56) KDM4ELMNATP53FLT3MAPT
SCHEMBL5323920 0.71 KDM4E (0.60) KDM4EPTPN2PTPN1LMNATP53
SCHEMBL10472882 0.71 KDM4E (0.47) KDM4ELMNATP53L3MBTL1MAPT
SCHEMBL30509203 0.71 KDM4E (0.60) KDM4EPTPN2PTPN1LMNATP53

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5523279-A COMPOSITION FOR CONTROLLING MONOCOTYLEDENOUS AND DICOTYLEDENOUS PLANT SPECIES AMERICAN CYANAMID COMPANY (US) 1996-06-04 US disclosed
US-5516751-A NONPHYTOTOXIC; SUGAR BEETS, SOYBEANS AMERICAN CYANAMID COMPANY (US) 1996-05-14 US disclosed
EP-0474991-B1 Herbicidal 2-(2-imidazolin -2-yl)-benzazoles AMERICAN CYANAMID CO (US) 1995-10-18 EP disclosed
US-5453415-A To control monocotyledons and dicotyledones; apply to foilage, soil, or water containing seeds; pre-and post-emergence AMERICAN CYANAMID COMPANY (US) 1995-09-26 US disclosed
US-5300479-A Pre-and postemergence herbicides AMERICAN CYANAMID COMPANY (US) 1994-04-05 US disclosed
US-5108485-A Controlling monocotyledonous and dicotyledonous plants AMERICAN CYANAMID COMPANY (US) 1992-04-28 US disclosed
EP-0474991-A1 Herbicidal 2-(2-imidazolin -2-yl)-benzazoles AMERICAN CYANAMID COMPANY (US) 1992-03-18 EP disclosed