SCHEMBL17428138

SCHEMBL17428138

O=C(CO[C@H]1C(O)[C@@H](CO)O[C@H]1n1cnc2c(NC(=O)c3ccccc3)ncnc21)NCCNC(=O)C(F)(F)F

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ADORA1 P30542 7/20 0.51
▸ ADORA3 P0DMS8 3/20 0.51
▸ ADORA2A P29274 2/20 0.51
▸ ADORA2B P29275 1/20 0.51
▸ SLC29A1 Q99808 2/20 0.48
▸ TP53 P04637 1/20 0.48
▸ TDP1 Q9NUW8 1/20 0.48
▸ LMNA P02545 2/20 0.47
▸ TSHR P16473 2/20 0.47
▸ NFKB1 P19838 2/20 0.47
▸ THPO P40225 2/20 0.47
▸ ALDH1A1 P00352 1/20 0.47
▸ GLA P06280 1/20 0.47
▸ PMP22 Q01453 1/20 0.47
▸ SMN1; SMN2 Q16637 1/20 0.47
▸ NPC1 O15118 1/20 0.47
▸ NPY1R P25929 1/20 0.47
▸ HTT P42858 1/20 0.47
▸ NPY2R P49146 1/20 0.47
▸ RAB9A P51151 1/20 0.47

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
SCHEMBL18950649 0.91 ADORA3 (0.46) ADORA1ADORA3
SCHEMBL19509820 0.89 ADORA1 (0.50) ADORA1ADORA3ADORA2AADORA2BSLC29A1
SCHEMBL19500431 0.89 ADORA1 (0.50) ADORA1ADORA3ADORA2AADORA2BSLC29A1
SCHEMBL21652362 0.89 ADORA1 (0.50) ADORA1ADORA3ADORA2AADORA2BSLC29A1
SCHEMBL17428139 0.84 ADORA1 (0.59) ADORA1ADORA3ADORA2AADORA2BSLC29A1
SCHEMBL6515190 0.84 LMNA (0.55) ADORA1ADORA3ADORA2AADORA2BSLC29A1
SCHEMBL6515178 0.84 LMNA (0.55) ADORA1ADORA3ADORA2AADORA2BSLC29A1
SCHEMBL6899424 0.83 ADORA1 (0.56) ADORA1ADORA3ADORA2AADORA2BSLC29A1
SCHEMBL6899430 0.83 ADORA1 (0.56) ADORA1ADORA3ADORA2AADORA2BSLC29A1
SCHEMBL19407591 0.83 ADORA1 (0.56) ADORA1ADORA3ADORA2AADORA2BSLC29A1

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-9463200-B2 Cell-penetrating oligonucleotides OLIGOMER SCIENCES AB (SE) 2016-10-11 — — US disclosed
US-20160008389-A1 Cell-Penetrating Oligonucleotides ASTRAZENECA AB (SE) 2016-01-14 — — 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-20160008389-A1 Cell-Penetrating Oligonucleotides SLC29A1, SLC29A2, TYMP ADORA1 8/4885ADORA3 10/4885ADORA2A 28/4885

“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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