SCHEMBL5694080

SCHEMBL5694080

C=CCOC(=O)OC[C@H]1O[C@@H](n2ccc(N)nc2=O)[C@H](O[Si](C)(C)C(C)(C)C)[C@@H]1OP(=O)(OCC=C)OCCC#N

nearest known ligand 0.40

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ POLA1 P09884 1/20 0.35
▸ TSHR P16473 1/20 0.34
▸ GLA P06280 1/20 0.34
▸ ST6GAL1 P15907 7/20 0.33
▸ P2RY2 P41231 1/20 0.33
▸ LMNA P02545 1/20 0.33
▸ THRB P10828 1/20 0.33
▸ MTOR P42345 1/20 0.33
▸ MDM2 Q00987 1/20 0.33
▸ NCOA1 Q15788 1/20 0.33
▸ NCOA3 Q9Y6Q9 1/20 0.33
▸ POLB P06746 1/20 0.32
▸ P2RY6 Q15077 1/20 0.31

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
SCHEMBL5694099 0.88 POLA1 (0.37) POLA1TSHRGLAST6GAL1P2RY2
SCHEMBL5694132 0.83 ADORA1 (0.42) P2RY2
SCHEMBL5694113 0.81 POLB (0.42) POLA1ST6GAL1P2RY2LMNAPOLB
SCHEMBL5908145 0.80 ST6GAL1 (0.39) POLA1TSHRGLAST6GAL1P2RY2
SCHEMBL5694048 0.79 P2RY6 (0.43) P2RY2POLBP2RY6
SCHEMBL5908151 0.76 P2RY6 (0.42) ST6GAL1P2RY2POLBP2RY6
SCHEMBL5694075 0.73 POLB (0.41) POLA1ST6GAL1P2RY2POLBP2RY6
SCHEMBL5183563 0.72 LMNA (0.34) POLA1TSHRGLAST6GAL1LMNA
SCHEMBL5694389 0.71 DNMT1 (0.40) LMNAMTORPOLB
SCHEMBL13794604 0.71 ALDH1A1 (0.45) TSHRGLAST6GAL1LMNATHRB

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-20060167241-A1 Method for synthesizing cyclic bisdinucleoside MITSUI CHEMICALS, INC. (JP) 2006-07-27 — — US disclosed
EP-1645561-A1 METHOD OF SYNTHESIZING CYCLIC BISDINUCLEOSIDE Mitsui Chemicals, Inc. (JP) 2006-04-12 — — 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 (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-20060167241-A1 Method for synthesizing cyclic bisdinucleoside NSUN2, POLR2H, POLB POLA1 45/4885TSHR 1768/4885GLA 3755/4885

“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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