SCHEMBL15930980

SCHEMBL15930980

C=P(C)(C)CC[C@@]1(C)O[C@@H](n2cnc3c(N)ccnc32)[C@H](C)[C@@H]1O

nearest known ligand 0.43

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ ADORA2A P29274 3/20 0.43
▸ ADORA2B P29275 3/20 0.43
▸ AHCY P23526 1/20 0.42
▸ DNMT1 P26358 1/20 0.38
▸ DNMT3B Q9UBC3 1/20 0.38
▸ PI4KA P42356 1/20 0.33
▸ PI4K2B Q8TCG2 1/20 0.33
▸ PI4K2A Q9BTU6 1/20 0.33
▸ PI4KB Q9UBF8 1/20 0.33
▸ PRMT5 O14744 1/20 0.33
▸ WDR77 Q9BQA1 1/20 0.33
▸ AMD1 P17707 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
SCHEMBL16489873 1.00 ADORA2A (0.43) ADORA2AADORA2BAHCYDNMT1DNMT3B
SCHEMBL14929097 0.91 ADORA2A (0.46) ADORA2AADORA2BAHCYDNMT1DNMT3B
SCHEMBL14946120 0.91 ADORA2A (0.46) ADORA2AADORA2BAHCYDNMT1DNMT3B
SCHEMBL18947537 0.84 AHCY (0.50) ADORA2AADORA2BAHCYDNMT1DNMT3B
SCHEMBL18858889 0.82 AHCY (0.41) ADORA2AADORA2BAHCYDNMT1DNMT3B
SCHEMBL14946103 0.80 ADORA2A (0.42) ADORA2AADORA2BAHCYDNMT1DNMT3B
SCHEMBL14928579 0.80 ADORA2A (0.42) ADORA2AADORA2BAHCYDNMT1DNMT3B
SCHEMBL15746179 0.80 ADORA2A (0.43) ADORA2AADORA2BAHCYDNMT1DNMT3B
SCHEMBL15723511 0.80 ADORA2A (0.47) ADORA2AADORA2BAHCYDNMT1DNMT3B
SCHEMBL14946122 0.77 ADORA2A (0.48) ADORA2AADORA2BAHCYDNMT1DNMT3B

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-9089604-B2 Modified polynucleotides for treating galactosylceramidase protein deficiency MODERNA THERAPEUTICS, INC. (US) 2015-07-28 — — US disclosed
US-20140221465-A1 MODIFIED POLYNUCLEOTIDES FOR TREATING GALACTOSYLCERAMIDASE PROTEIN DEFICIENCY MODERNA THERAPEUTICS, INC. (US) 2014-08-07 — — 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-20140221465-A1 MODIFIED POLYNUCLEOTIDES FOR TREATING GALACTOSYLCERAMIDASE PROTEIN DEFICIENCY GBA1, GALC, GALNT1 ADORA2A 1966/4885ADORA2B 1870/4885AHCY 1444/4885

“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.

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