SCHEMBL3514758

SCHEMBL3514758

Nc1ncnc2c1ncn2[C@]1(c2cccc3ccccc23)O[C@H](CO)[C@@H](O)[C@H]1O

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SLC28A2 O43868 2/20 0.45
PI4KA P42356 3/20 0.44
PI4K2B Q8TCG2 3/20 0.44
PI4K2A Q9BTU6 3/20 0.44
PI4KB Q9UBF8 3/20 0.44
ADORA3 P0DMS8 4/20 0.44
ADORA2A P29274 3/20 0.44
SLC28A1 O00337 2/20 0.44
GAPDH P04406 2/20 0.44
DPP4 P27487 1/20 0.44
MEN1 O00255 1/20 0.44
MAP3K7 O43318 1/20 0.44
MAPK1 P28482 1/20 0.44
ADORA2B P29275 1/20 0.44
ADORA1 P30542 1/20 0.44
STAT6 P42226 1/20 0.44
KMT2A Q03164 1/20 0.44
SMN1; SMN2 Q16637 1/20 0.44
DOT1L Q8TEK3 1/20 0.44
SLC29A1 Q99808 1/20 0.44

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
SCHEMBL9491636 0.88 ADORA3 (0.47) SLC28A2PI4KAPI4K2BPI4K2API4KB
SCHEMBL1434028 0.85 ADORA3 (0.49) SLC28A2PI4KAPI4K2BPI4K2API4KB
SCHEMBL10645028 0.84 ADORA3 (0.42) SLC28A2PI4KAPI4K2BPI4K2API4KB
SCHEMBL9341012 0.84 PI4KA (0.43) SLC28A2PI4KAPI4K2BPI4K2API4KB
SCHEMBL7208241 0.83 ADORA3 (0.43) SLC28A2PI4KAPI4K2BPI4K2API4KB
SCHEMBL28905612 0.83 ADORA3 (0.42) SLC28A2PI4KAPI4K2BPI4K2API4KB
SCHEMBL10345558 0.82 ADORA3 (0.42) SLC28A2PI4KAPI4K2BPI4K2API4KB
SCHEMBL10606024 0.81 SLC28A2 (0.49) SLC28A2PI4KAPI4K2BPI4K2API4KB
SCHEMBL6426189 0.81 SLC28A2 (0.43) SLC28A2PI4KAPI4K2BPI4K2API4KB
SCHEMBL27412560 0.80 ADORA3 (0.39) SLC28A2PI4KAPI4K2BPI4K2API4KB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20120135092-A1 INHIBITORS OF RecA ACTIVITIES FOR CONTROL OF ANTIBIOTIC-RESISTANT BACTERIAL PATHOGENS UNIVERSITY OF NORTH CAROLINA AT CHAPEL HILL, THE 2012-05-31 US disclosed
US-20100292135-A1 INHIBITORS OF RecA ACTIVITIES FOR CONTROL OF ANTIBIOTIC-RESISTANT BACTERIAL PATHOGENS NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT 2010-11-18 US disclosed
US-20060199768-A1 Inhibitors of RecA activities for control of antibiotic-resistant bacterial pathogens UNIVERSITY OF NORTH CAROLINA AT CHAPEL HILL 2006-09-07 US disclosed
EP-0179631-B1 N6-ACENAPHTHYL ADENOSINES AND ANALOGS THEREOF WARNER-LAMBERT COMPANY (US) 1989-04-26 EP disclosed
EP-0179631-A2 N6-acenaphthyl adenosines and analogs thereof WARNER-LAMBERT COMPANY (US) 1986-04-30 EP disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (3 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20060199768-A1 Inhibitors of RecA activities for control of antibiotic-resistant bacterial pathogens RECQL, DNA2, WRN SLC28A2 1836/4885PI4KA 3242/4885PI4K2B 3921/4885
US-20100292135-A1 INHIBITORS OF RecA ACTIVITIES FOR CONTROL OF ANTIBIOTIC-RESISTANT BACTERIAL PATHOGENS RECQL, DNA2, WRN SLC28A2 1836/4885PI4KA 3242/4885PI4K2B 3921/4885
US-20120135092-A1 INHIBITORS OF RecA ACTIVITIES FOR CONTROL OF ANTIBIOTIC-RESISTANT BACTERIAL PATHOGENS RECQL, WRN, ADAR SLC28A2 1227/4885PI4KA 3047/4885PI4K2B 3819/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.