SCHEMBL12360852

SCHEMBL12360852

COC[C@@]12CO[C@@H](C1OC)[C@H](n1cnc3c(N)ncnc31)O2

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PI4KA P42356 2/20 0.46
▸ PI4K2B Q8TCG2 2/20 0.46
▸ PI4K2A Q9BTU6 2/20 0.46
▸ PI4KB Q9UBF8 2/20 0.46
▸ PRMT5 O14744 1/20 0.44
▸ WDR77 Q9BQA1 1/20 0.44
▸ RXFP1 Q9HBX9 1/20 0.43
▸ AHCY P23526 5/20 0.42
▸ NADK O95544 1/20 0.42
▸ GAA P10253 1/20 0.42
▸ ADORA2A P29274 1/20 0.42
▸ TP53 P04637 1/20 0.42
▸ CYP2C9 P11712 1/20 0.42
▸ NFKB1 P19838 1/20 0.42
▸ MAPK1 P28482 1/20 0.42
▸ HSD17B10 Q99714 1/20 0.42
▸ MEN1 O00255 1/20 0.42
▸ ALDH1A1 P00352 1/20 0.42
▸ APEX1 P27695 1/20 0.42
▸ BLM P54132 1/20 0.42

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
SCHEMBL19840286 1.00 PI4KA (0.46) PI4KAPI4K2BPI4K2API4KBPRMT5
SCHEMBL12377338 1.00 PI4KA (0.46) PI4KAPI4K2BPI4K2API4KBPRMT5
SCHEMBL18520014 0.91 PI4KA (0.47) PI4KAPI4K2BPI4K2API4KBPRMT5
SCHEMBL14512798 0.91 PI4KA (0.47) PI4KAPI4K2BPI4K2API4KBPRMT5
SCHEMBL23618922 0.91 PI4KA (0.43) PI4KAPI4K2BPI4K2API4KBPRMT5
SCHEMBL23645691 0.91 PI4KA (0.43) PI4KAPI4K2BPI4K2API4KBPRMT5
SCHEMBL12015153 0.90 PI4KA (0.45) PI4KAPI4K2BPI4K2API4KBPRMT5
SCHEMBL12360850 0.90 PI4KA (0.45) PI4KAPI4K2BPI4K2API4KBPRMT5
SCHEMBL22855555 0.90 PI4KA (0.45) PI4KAPI4K2BPI4K2API4KBPRMT5
SCHEMBL12087562 0.90 PI4KA (0.45) PI4KAPI4K2BPI4K2API4KBPRMT5

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-9885036-B2 Double-stranded polynucleotide DAIICHI SANKYO COMPANY, LIMITED (JP) 2018-02-06 — — US disclosed
US-7994152-B2 Method of treating a cancer by administering A 2′,5′-oligoadenylate analog SANKYO COMPANY, LIMITED (JP) 2011-08-09 — — US disclosed
US-20110152353-A1 DOUBLE-STRANDED POLYNUCLEOTIDE DAIICHI SANKYO COMPANY, LIMITED 2011-06-23 — — US disclosed
US-20100035976-A1 Method of treating a tumor or a viral disease by administering a 2' , 5' -oligoadenylate analog SANKYO COMPANY, LIMITED (JP) 2010-02-11 — — US disclosed
US-7651999-B2 phosphorothioate modification containg oligonadenylates useful as antiviral, anticarcinogenic and antitumor agent; stable and have superior activity for treating lung cancer SANKYO COMPANY, LIMITED (JP) 2010-01-26 — — 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 (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-20110152353-A1 DOUBLE-STRANDED POLYNUCLEOTIDE NSUN2, TRDMT1, POLRMT PI4KA 2488/4885PI4K2B 1617/4885PI4K2A 1568/4885
US-20100035976-A1 Method of treating a tumor or a viral disease by administering a 2' , 5' -oligoadenylate analog ADAR, NSUN2, ADORA3 PI4KA 2525/4885PI4K2B 2800/4885PI4K2A 2461/4885

“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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