SCHEMBL11087459

SCHEMBL11087459

N#Cc1nc(Cl)c(-c2cccc(Br)c2)nc1C#N

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MYC P01106 1/20 0.45
WDR5 P61964 1/20 0.45
SMN1; SMN2 Q16637 2/20 0.43
KDM4E B2RXH2 2/20 0.43
RXFP1 Q9HBX9 1/20 0.43
CTSS P25774 1/20 0.42
CTSK P43235 1/20 0.42
ADORA2A P29274 4/20 0.41
ADORA1 P30542 4/20 0.41
ADORA2B P29275 2/20 0.41
RAB9A P51151 3/20 0.39
NPC1 O15118 2/20 0.39
TP53 P04637 2/20 0.39
TSHR P16473 1/20 0.39
DCUN1D1 Q96GG9 2/20 0.39
IDO1 P14902 1/20 0.39
ALDH1A1 P00352 4/20 0.39
HPGD P15428 3/20 0.39
LMNA P02545 1/20 0.39
MEN1 O00255 1/20 0.38

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
SCHEMBL11091380 0.85 ADORA1 (0.56) KDM4ECTSSCTSKADORA2AADORA1
SCHEMBL11401495 0.83 ADORA1 (0.50) KDM4ERXFP1ADORA2AADORA1ADORA2B
SCHEMBL11084545 0.81 KDM4E (0.55) SMN1; SMN2KDM4EADORA2AADORA1ADORA2B
SCHEMBL13864593 0.77 KDM4E (0.65) SMN1; SMN2KDM4ERAB9ANPC1TP53
SCHEMBL11090534 0.75 CTSS (0.49) MYCWDR5SMN1; SMN2KDM4ERXFP1
SCHEMBL29907743 0.73 ADORA1 (0.53) KDM4ERXFP1ADORA2AADORA1ADORA2B
SCHEMBL22551879 0.73 ADORA1 (0.53) KDM4ERXFP1ADORA2AADORA1ADORA2B
SCHEMBL11090728 0.72 CTSS (0.46) MYCWDR5SMN1; SMN2KDM4ERXFP1
SCHEMBL11092179 0.71 L3MBTL1 (0.54) MYCWDR5KDM4EADORA2AADORA1
SCHEMBL11443110 0.71 MAPT (0.50) MYCWDR5SMN1; SMN2KDM4ERXFP1

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-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