SCHEMBL16158849

SCHEMBL16158849

C=C1NC(=O)C(C)=CN1[C@@H]1O[C@@H]2COP(=O)(SC)OC2C1O

nearest known ligand 0.35

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ PDE4A P27815 8/20 0.35
▸ PDE4B Q07343 8/20 0.35
▸ PDE4C Q08493 8/20 0.35
▸ PDE4D Q08499 8/20 0.35
▸ STING1 Q86WV6 8/20 0.35
▸ PDE3B Q13370 1/20 0.33
▸ PDE3A Q14432 1/20 0.33
▸ RXFP1 Q9HBX9 1/20 0.32
▸ LMNA P02545 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
SCHEMBL16158819 0.82 STING1 (0.33) PDE4APDE4BPDE4CPDE4DSTING1
SCHEMBL16158841 0.80 PDE4A (0.39) PDE4APDE4BPDE4CPDE4DSTING1
SCHEMBL10150520 0.79 DHFR (0.39) —
SCHEMBL16158818 0.78 TDP1 (0.34) PDE4APDE4BPDE4CPDE4DSTING1
SCHEMBL16158835 0.77 RXFP1 (0.33) PDE4APDE4BPDE4CPDE4DSTING1
SCHEMBL17826624 0.73 DHFR (0.53) PDE4APDE4BPDE4CPDE4DSTING1
SCHEMBL17826380 0.72 PDE4A (0.40) PDE4APDE4BPDE4CPDE4DSTING1
SCHEMBL17826621 0.67 LMNA (0.47) PDE4APDE4BPDE4CPDE4DSTING1
SCHEMBL18016510 0.66 CHEK1 (0.34) LMNA
SCHEMBL18016507 0.65 ADORA3 (0.36) LMNA

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-9365605-B2 Cyclic nucleotide analogs ALIOS BIOPHARMA, INC. (US) 2016-06-14 — — US disclosed
US-20140303108-A1 CYCLIC NUCLEOTIDE ANALOGS ALIOS BIOPHARMA, INC. 2014-10-09 — — 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-20140303108-A1 CYCLIC NUCLEOTIDE ANALOGS NT5C2, NTPCR, PNP PDE4A 22/4885PDE4B 28/4885PDE4C 23/4885

“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.

Send feedback