SCHEMBL8388991

SCHEMBL8388991

NCCCCCCNOC[C@H]1O[C@@H](n2cnc3c(N)ncnc32)[C@H](O)[C@@H]1O

nearest known ligand 0.68

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DOT1L Q8TEK3 3/20 0.66
DNMT3B Q9UBC3 2/20 0.66
PRMT7 Q9NVM4 1/20 0.66
SRM P19623 4/20 0.64
SMS P52788 2/20 0.64
PRKACA P17612 2/20 0.63
PNMT P11086 1/20 0.62
DNMT1 P26358 1/20 0.62
NADK O95544 1/20 0.62
AHCY P23526 1/20 0.62
ADORA1 P30542 3/20 0.61
SMN1; SMN2 Q16637 2/20 0.61
ADORA3 P0DMS8 2/20 0.61
ADORA2A P29274 2/20 0.61
ADORA2B P29275 2/20 0.61
DPP4 P27487 1/20 0.61
MEN1 O00255 1/20 0.61
SLC28A1 O00337 1/20 0.61
MAP3K7 O43318 1/20 0.61
SLC28A2 O43868 1/20 0.61

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
SCHEMBL7610250 0.92 EHMT1 (0.71) PRKACANADK
SCHEMBL1900946 0.90 EHMT1 (0.70) DOT1LPRKACANADKAHCYADORA1
SCHEMBL12450414 0.86 P2RY1 (0.72) ADORA1SMN1; SMN2DNPH1PRKAB2TRPM2
SCHEMBL10886673 0.85 DOT1L (0.66) DOT1LDNMT3BPRMT7SRMSMS
SCHEMBL6569310 0.85 ADORA1 (0.73) DOT1LNADKAHCYADORA1SMN1; SMN2
SCHEMBL8007640 0.85 DOT1L (0.65) DOT1LDNMT3BPRMT7SRMSMS
SCHEMBL9549055 0.84 RNASEL (0.62) SMN1; SMN2SRCP2RY2P2RY1
SCHEMBL6026064 0.84 PRKACA (0.67) PRKACAADORA1SMN1; SMN2DNPH1PRKAB2
SCHEMBL939593 0.84 ADORA1 (0.71) DOT1LNADKAHCYADORA1SMN1; SMN2
SCHEMBL8708990 0.84 ADORA1 (0.71) DOT1LNADKAHCYADORA1SMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5928862-A CONTACTING SAMPLE WITH LABELED POLYNUCLEOTIDE PROBES CAPABLE OF TWO POSTIONS, EITHER BOUND TO EACH OTHER WHERE LABELS CAN INTERACT OR ONE BOUND TO TARGET IN SAMPLE; MONITORING FOR SIGNAL INDICATIVE OF PRESENCE OF TARGET AMOCO CORPORATION (US) 1999-07-27 US disclosed
EP-0232967-B1 COMPETITIVE HOMOGENEOUS ASSAY AMOCO CORPORATION (US) 1993-04-28 EP disclosed
EP-0232967-A2 Competitive homogeneous Assay AMOCO CORPORATION (US) 1987-08-19 EP disclosed