SCHEMBL3306409

SCHEMBL3306409

CC(=CCn1cnc2ncnc(N)c21)CO

nearest known ligand 0.65

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
AHCY P23526 9/20 0.65
ADORA2A P29274 7/20 0.57
ADORA1 P30542 4/20 0.43
EGFR P00533 1/20 0.40
SRC P12931 1/20 0.40
KDR P35968 1/20 0.40
TEK Q02763 1/20 0.40
PIK3CD O00329 2/20 0.38
PI4KA P42356 1/20 0.37
PI4K2B Q8TCG2 1/20 0.37
PI4K2A Q9BTU6 1/20 0.37
PI4KB Q9UBF8 1/20 0.37

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
SCHEMBL4541360 0.87 ADORA2A (0.62) AHCYADORA2AADORA1EGFRSRC
SCHEMBL8186426 0.79 AHCY (1.00) AHCYADORA2AADORA1PI4KAPI4K2B
SCHEMBL1665301 0.77 ADORA2A (0.69) AHCYADORA2AADORA1EGFRSRC
SCHEMBL9778803 0.76 ADORA2A (0.63) AHCYADORA2AADORA1EGFRSRC
SCHEMBL4815870 0.74 ADORA2A (0.71) AHCYADORA2AADORA1EGFRSRC
SCHEMBL5801729 0.74 ADORA2A (1.00) AHCYADORA2AADORA1EGFRSRC
SCHEMBL1665392 0.72 ADORA2A (0.71) AHCYADORA2AADORA1EGFRSRC
SCHEMBL28115748 0.71 ADORA2A (0.64) AHCYADORA2AADORA1EGFRSRC
SCHEMBL6690627 0.69 ADORA2A (0.56) AHCYADORA2AADORA1EGFRSRC
SCHEMBL8584781 0.68 ADORA2A (0.64) AHCYADORA2AADORA1EGFRSRC

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-8293682-B2 Growth regulators for gramineous weeds RIKENGREEN CO., LTD. (JP) 2012-10-23 US disclosed
US-20100099567-A1 GROWTH REGULATORS FOR GRAMINEOUS WEEDS RIKENGREEN CO., LTD. (JP) 2010-04-22 US disclosed