SCHEMBL17211614

SCHEMBL17211614

Nc1ccn(C[C@@H]2O[C@H](CO)[C@@H](O)C2(F)F)c(=O)n1

nearest known ligand 0.65

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PDE3A Q14432 3/20 0.65
▸ PDE4D Q08499 1/20 0.65
▸ SLC29A1 Q99808 1/20 0.65
▸ LMNA P02545 4/20 0.50
▸ THRB P10828 1/20 0.50
▸ MTOR P42345 1/20 0.50
▸ MDM2 Q00987 1/20 0.50
▸ NCOA1 Q15788 1/20 0.50
▸ NCOA3 Q9Y6Q9 1/20 0.50
▸ FGFR1 P11362 2/20 0.41
▸ POLA1 P09884 2/20 0.41
▸ CACNA1F O60840 2/20 0.40
▸ ALB P02768 2/20 0.40
▸ MAPT P10636 2/20 0.40
▸ CACNA1D Q01668 2/20 0.40
▸ CACNA1S Q13698 2/20 0.40
▸ CACNA1C Q13936 2/20 0.40
▸ SMN1; SMN2 Q16637 2/20 0.39
▸ POLB P06746 1/20 0.39
▸ ALDH1A1 P00352 1/20 0.39

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
SCHEMBL20820175 0.85 PDE3A (0.53) PDE3APDE4DSLC29A1LMNATHRB
Gemcitabine SCHEMBL19235640 0.79 PDE3A (1.00) PDE3APDE4DSLC29A1LMNATHRB
Gemcitabine SCHEMBL9140896 0.79 PDE3A (1.00) PDE3APDE4DSLC29A1LMNATHRB
Gemcitabine SCHEMBL9143689 0.79 PDE3A (1.00) PDE3APDE4DSLC29A1LMNATHRB
Gemcitabine SCHEMBL9140892 0.79 PDE3A (1.00) PDE3APDE4DSLC29A1LMNATHRB
Gemcitabine SCHEMBL18389585 0.79 PDE3A (1.00) PDE3APDE4DSLC29A1LMNATHRB
Gemcitabine SCHEMBL18768286 0.79 PDE3A (1.00) PDE3APDE4DSLC29A1LMNATHRB
Gemcitabine SCHEMBL20827751 0.79 PDE3A (1.00) PDE3APDE4DSLC29A1LMNATHRB
Gemcitabine SCHEMBL366874 0.79 PDE3A (1.00) PDE3APDE4DSLC29A1LMNATHRB
Gemcitabine SCHEMBL13262185 0.79 PDE3A (1.00) PDE3APDE4DSLC29A1LMNATHRB

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 7 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10946100-B2 Polymers including active agents MICROVENTION, INC. (US) 2021-03-16 — — US disclosed
US-20190151452-A1 Polymers Including Active Agents MICROVENTION, INC. 2019-05-23 — — US disclosed
US-10226533-B2 Polymer filaments including pharmaceutical agents and delivering same MICROVENTION, INC. (US) 2019-03-12 — — US disclosed
EP-3137124-B1 POLYMERS INCLUDING ACTIVE AGENTS MICROVENTION INC (US) 2019-01-09 — — EP disclosed
WO-2015167752-A1 POLYMERS INCLUDING ACTIVE AGENTS MICROVENTION, INC. (US) 2015-11-05 — — WO disclosed
US-20150306227-A1 POLYMERS INCLUDING ACTIVE AGENTS MICROVENTION, INC. 2015-10-29 — — US disclosed
US-20150306227-A1 POLYMERS INCLUDING ACTIVE AGENTS MICROVENTION, INC. 2015-10-29 — — 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 (4 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-10226533-B2 Polymer filaments including pharmaceutical agents and delivering same MFAP1, ACTB, MAPT PDE3A 2156/4885PDE4D 2220/4885SLC29A1 4062/4885
US-20190151452-A1 Polymers Including Active Agents MFAP1, VCL, ACTB PDE3A 3806/4885PDE4D 3708/4885SLC29A1 4481/4885
US-10946100-B2 Polymers including active agents MFAP1, VCL, ACTB PDE3A 3806/4885PDE4D 3708/4885SLC29A1 4481/4885
US-20150306227-A1 POLYMERS INCLUDING ACTIVE AGENTS MFAP1, VCL, ACTB PDE3A 3806/4885PDE4D 3708/4885SLC29A1 4481/4885

“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