SCHEMBL6514006

SCHEMBL6514006

COc1ccc(C(c2ccccc2)(c2ccc(OC)cc2)C(O)[C@@]23CO[C@@H]([C@H](n4cnc5c(NC(=O)c6ccccc6)ncnc54)O2)[C@@H]3OP(OCCC#N)N(C(C)C)C(C)C)cc1

nearest known ligand 0.40

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
PRMT6 Q96LA8 1/20 0.33
ADORA2B P29275 3/20 0.33
ADORA2A P29274 2/20 0.33
P2RY12 Q9H244 1/20 0.33
ADORA3 P0DMS8 2/20 0.32
ADORA1 P30542 2/20 0.32
PRKAG1 P54619 1/20 0.32
PRKAA1 Q13131 1/20 0.32
PRKAB1 Q9Y478 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
SCHEMBL211495 0.93 ADORA2B (0.33) PRMT6ADORA2BADORA2AP2RY12ADORA3
SCHEMBL210112 0.93 ADORA2B (0.33) PRMT6ADORA2BADORA2AP2RY12ADORA3
SCHEMBL5558224 0.89 TYMP (0.34) PRMT6ADORA2BADORA2AP2RY12ADORA3
SCHEMBL1096766 0.89 TYMP (0.34) PRMT6ADORA2BADORA2AP2RY12ADORA3
SCHEMBL29881527 0.89 TYMP (0.34) PRMT6ADORA2BADORA2AP2RY12ADORA3
SCHEMBL19814045 0.88 PRMT6 (0.33) PRMT6ADORA2BADORA2AP2RY12ADORA3
SCHEMBL19825361 0.88 PRMT6 (0.33) PRMT6ADORA2BADORA2AP2RY12ADORA3
SCHEMBL211959 0.86 ADORA2A (0.32) PRMT6ADORA2BADORA2AP2RY12ADORA3
SCHEMBL19566538 0.86 PRMT6 (0.37) PRMT6ADORA2BADORA2AP2RY12ADORA1
SCHEMBL25727 0.86 TYMP (0.33) PRMT6ADORA2BADORA2AP2RY12PRKAG1

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-8703728-B2 Gapped oligomeric compounds having linked bicyclic sugar moieties at the termini ISIS PHARMACEUTICALS, INC. (US) 2014-04-22 US disclosed
US-20050059066-A1 Gapped oligomeric compounds having linked bicyclic sugar moieties at the termini IONIS PHARMACEUTICALS, INC. 2005-03-17 US 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 (1 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-20050059066-A1 Gapped oligomeric compounds having linked bicyclic sugar moieties at the termini OGG1, UNG, PCNA PRMT6 4128/4885ADORA2B 3328/4885ADORA2A 1299/4885

“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.