SCHEMBL4351091

SCHEMBL4351091

Nc1ncnc2c1ncn2[C@H]1CC[C@@H](O)C1

nearest known ligand 0.75

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
ADORA2A P29274 4/20 0.75
PI4KA P42356 3/20 0.67
PI4K2B Q8TCG2 3/20 0.67
PI4K2A Q9BTU6 3/20 0.67
PI4KB Q9UBF8 3/20 0.67
ADORA3 P0DMS8 2/20 0.67
ADORA1 P30542 2/20 0.67
ADORA2B P29275 1/20 0.67
ADCY5 O95622 9/20 0.64
AHCY P23526 2/20 0.59

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
SCHEMBL12321001 1.00 ADORA2A (0.75) ADORA2API4KAPI4K2BPI4K2API4KB
SCHEMBL30315880 1.00 ADORA2A (0.75) ADORA2API4KAPI4K2BPI4K2API4KB
SCHEMBL5188585 1.00 ADORA2A (0.75) ADORA2API4KAPI4K2BPI4K2API4KB
SCHEMBL987094 1.00 ADORA2A (0.75) ADORA2API4KAPI4K2BPI4K2API4KB
SCHEMBL9470633 0.90 ADORA2A (0.71) ADORA2API4KAPI4K2BPI4K2API4KB
SCHEMBL28984637 0.86 ADORA2A (1.00) ADORA2API4KAPI4K2BPI4K2API4KB
SCHEMBL27459374 0.84 ADORA2A (0.77) ADORA2API4KAPI4K2BPI4K2API4KB
SCHEMBL9685991 0.83 ADORA2A (0.50) ADORA2API4KAPI4K2BPI4K2API4KB
SCHEMBL10474172 0.82 ADCY5 (0.74) ADORA2API4KAPI4K2BPI4K2API4KB
SCHEMBL9309056 0.82 ADORA2A (0.69) ADORA2API4KAPI4K2BPI4K2API4KB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090280153-A1 electrical devices, anti-scarring agents, and therapeutic compositions ANGIOTECH INTERNATIONAL AG (CH) 2009-11-12 US disclosed
US-20090226500-A1 SUTURES AND ANTI-SCARRING AGENTS ANGIOTECH PHARMACEUTICALS, INC (CA) 2009-09-10 US disclosed
US-20070270441-A1 Combination ALTANA PHARMA AG (DE) 2007-11-22 US disclosed
WO-2006121522-A2 IMPLANTABLE SENSORS AND PUMPS, ANTI-SCARRING AGENTS, AND THERAPEUTIC COMPOSITIONS ANGIOTECH INTERNATIONAL AG (CH) 2006-11-16 WO disclosed
WO-2006121518-A2 ELECTRICAL DEVICES, ANTI-SCARRING AGENTS, AND THERAPEUTIC COMPOSITIONS ANGIOTECH INTERNATIONAL AG (CH) 2006-11-16 WO disclosed
EP-1448202-A1 COMBINATION OF A PDE4 OR PDE3/4 INHIBITOR AND AN ANTI-RHEUMATIC DRUG ALTANA Pharma AG (DE) 2004-08-25 EP disclosed
WO-2003039552-A1 COMBINATION OF PDE4 OR PDE3/4 INHIBITOR AND AN ANTI-RHEUMATIC DRUG ALTANA PHARMA AG (DE) 2003-05-15 WO disclosed
US-20030092706-A1 Combination NYCOMED GMBH (DE) 2003-05-15 US disclosed
CN-1031132-C Carbocyclic adenosine analogs useful as immunosuppressants MARION MERRELL DOW INC (US) 1996-02-28 CN 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 (2 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-20090226500-A1 SUTURES AND ANTI-SCARRING AGENTS COL1A1, COL2A1, COL14A1 ADORA2A 4072/4885PI4KA 3876/4885PI4K2B 4151/4885
US-20090280153-A1 electrical devices, anti-scarring agents, and therapeutic compositions GAP43, TNNC1, GJB2 ADORA2A 1424/4885PI4KA 3875/4885PI4K2B 4261/4885

“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.