SCHEMBL11095182

SCHEMBL11095182

N#Cc1nc(O)c(-c2ccccc2)nc1C#N

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CHEK1 O14757 1/20 0.50
ABL1 P00519 1/20 0.50
PDGFRB P09619 1/20 0.50
PDGFRA P16234 1/20 0.50
FLT1 P17948 1/20 0.50
GRK5 P34947 1/20 0.50
KDR P35968 1/20 0.50
MAP2K2 P36507 1/20 0.50
CDK8 P49336 1/20 0.50
GSK3A P49840 1/20 0.50
GSK3B P49841 1/20 0.50
PRKX P51817 1/20 0.50
NEK2 P51955 1/20 0.50
LIMK1 P53667 1/20 0.50
MAP2K1 Q02750 1/20 0.50
PRKCQ Q04759 1/20 0.50
MAP4K2 Q12851 1/20 0.50
DYRK1A Q13627 1/20 0.50
IKBKE Q14164 1/20 0.50
NTRK3 Q16288 1/20 0.50

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
SCHEMBL7537686 0.86 ERBB2 (0.59) CHEK1ABL1PDGFRBPDGFRAFLT1
SCHEMBL11084131 0.80 ADORA1 (0.54) ADORA1ADORA2AUSP8USP7USP47
SCHEMBL11084545 0.77 KDM4E (0.55) CHEK1ABL1PDGFRBPDGFRAFLT1
SCHEMBL19439626 0.77 CHEK1 (0.59) CHEK1ABL1PDGFRBPDGFRAFLT1
SCHEMBL11092132 0.77 ADORA1 (0.55) CHEK1ABL1PDGFRBPDGFRAFLT1
SCHEMBL15135221 0.77 MEN1 (0.50) ADORA1ADORA2AALDH1A1KDM4EHTT
SCHEMBL12343920 0.76 ERBB2 (0.53) CHEK1ABL1PDGFRBPDGFRAFLT1
SCHEMBL14306925 0.76 ERBB2 (0.53) CHEK1ABL1PDGFRBPDGFRAFLT1
SCHEMBL18748047 0.76 ADORA1 (0.61) CHEK1ABL1PDGFRBPDGFRAFLT1
SCHEMBL16291602 0.75 PGR (0.46) CHEK1ABL1PDGFRBPDGFRAFLT1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
JP-56002970-A None JP disclosed
JP-55115874-A None JP disclosed
US-4460403-A 2,3-Dicyano 6 phenyl pyrazine herbicides KYOWA GAS CHEMICAL INDUSTRY CO., LTD. (JP) 1984-07-17 US disclosed
US-4259489-A PREEMERGENCE AND POSTEMERGENCE HERBICIDES KYOWA GAS CHEMICAL INDUSTRY CO. LTD. (JP) 1981-03-31 US disclosed
JP-S562970-A PREPARATION OF NOVEL 2,3-DICYANO-5-CHLOROPYRAZINE DERIVATIVE KYOWA GAS CHEM IND CO LTD 1981-01-13 JP disclosed
JP-S55115874-A PREPARATION OF 2,3-DICYANO-5-HYDROXYPYRAZINE DERIVATIVE KYOWA GAS CHEM IND CO LTD 1980-09-06 JP disclosed