SCHEMBL9014935

SCHEMBL9014935

Nc1nc(N)c2nccnc2n1.c1cnc2ncncc2n1

nearest known ligand 0.66

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
ADORA2A P29274 1/20 0.66
DHFR P00374 1/20 0.38
PIK3CG P48736 6/20 0.36
PIK3CA P42336 1/20 0.33
PIK3CB P42338 1/20 0.33
HDAC6 Q9UBN7 1/20 0.33
NOS1 P29475 1/20 0.32

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
SCHEMBL478917 0.81 ADORA2A (1.00) ADORA2ADHFRPIK3CGPIK3CAPIK3CB
SCHEMBL29941435 0.81 ADORA2A (1.00) ADORA2ADHFRPIK3CGPIK3CAPIK3CB
Bromide SCHEMBL29767030 0.79 ADORA2A (0.95) ADORA2ADHFRPIK3CGPIK3CAPIK3CB
Bromide SCHEMBL64823 0.79 ADORA2A (0.95) ADORA2ADHFRPIK3CGPIK3CAPIK3CB
Hydrochloric Acid SCHEMBL6448601 0.79 ADORA2A (0.95) ADORA2ADHFRPIK3CGPIK3CAPIK3CB
SCHEMBL29355369 0.77 EGFR (0.34) PIK3CG
SCHEMBL7626 0.77 EGFR (0.34) PIK3CG
Phosphine SCHEMBL3090397 0.75 CHRNB4 (0.33) PIK3CG
Potassium SCHEMBL29619940 0.75 EGFR (0.33) PIK3CG
Hydrogen Sulfide SCHEMBL29184284 0.75 EGFR (0.33) PIK3CG

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5532367-A LARVICIDES FMC CORPORATION (US) 1996-07-02 US disclosed