SCHEMBL16320809

SCHEMBL16320809

CCCCCC(=O)CC(=O)OCc1ccc(OC)cc1

nearest known ligand 0.56

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ F2RL1 P55085 1/20 0.51
▸ ALDH1A1 P00352 4/20 0.51
▸ CNR1 P21554 3/20 0.49
▸ HDAC3 O15379 1/20 0.48
▸ HDAC1 Q13547 1/20 0.48
▸ HDAC2 Q92769 1/20 0.48
▸ KMT2A Q03164 2/20 0.47
▸ LMNA P02545 1/20 0.47
▸ MAPK1 P28482 1/20 0.46
▸ L3MBTL1 Q9Y468 1/20 0.46
▸ CNR2 P34972 1/20 0.45
▸ HTT P42858 1/20 0.45

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
SCHEMBL8084703 0.88 CNR1 (0.50) ALDH1A1CNR1KMT2AMAPK1L3MBTL1
SCHEMBL4205589 0.87 CNR1 (0.52) ALDH1A1CNR1MAPK1L3MBTL1
SCHEMBL4220980 0.87 CNR1 (0.52) ALDH1A1CNR1MAPK1L3MBTL1
SCHEMBL4214273 0.87 CNR1 (0.52) ALDH1A1CNR1MAPK1L3MBTL1
SCHEMBL28348314 0.87 CNR1 (0.52) ALDH1A1CNR1MAPK1L3MBTL1
SCHEMBL4214279 0.87 CNR1 (0.52) ALDH1A1CNR1MAPK1L3MBTL1
SCHEMBL4210164 0.87 CNR1 (0.52) ALDH1A1CNR1MAPK1L3MBTL1
SCHEMBL4214982 0.87 CNR1 (0.52) ALDH1A1CNR1MAPK1L3MBTL1
SCHEMBL7500299 0.84 ALDH1A1 (0.50) ALDH1A1HDAC3HDAC1HDAC2KMT2A
SCHEMBL16324874 0.84 ALDH1A1 (0.57) F2RL1ALDH1A1KMT2AMAPK1L3MBTL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20150175556-A1 DIHYDROPYRIMIDIN-2(1H)-ONES AND DIHYDROPYRIMIDIN-2(1H)-THIONES AS INHIBITORS OF SODIUM IODIDE SYMPORTER COMMISSARIAT A L'ENERGIE ATOMIQUE ET AUX ENERGIES ALTERNATIVES (FR) 2015-06-25 — — US disclosed
EP-2867213-A1 DIHYDROPYRIMIDIN-2(1H)-ONES AND DIHYDROPYRIMIDIN-2(1H)-THIONES AS INHIBITORS OF SODIUM IODIDE SYMPORTER Commissariat à l'Énergie Atomique et aux Énergies Alternatives (FR) 2015-05-06 — — EP disclosed
WO-2014203044-A1 DIHYDROPYRIMIDIN-2(1H)-ONES AND DIHYDROPYRIMIDIN-2(1H)-THIONES AS INHIBITORS OF SODIUM IODIDE SYMPORTER COMMISSARIAT A L'ENERGIE ATOMIQUE ET AUX ENERGIES ALTERNATIVES (FR) 2014-12-24 — — WO disclosed
EP-2682389-A1 Dihydropyrimidin-2(1H)-ones and dihydropyrimidin-2(1H)-thiones as inhibitors of sodium iodide symporter COMMISSARIAT A L'ENERGIE ATOMIQUE ET AUX ENERGIES ALTERNATIVES (FR) 2014-01-08 — — 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-20150175556-A1 DIHYDROPYRIMIDIN-2(1H)-ONES AND DIHYDROPYRIMIDIN-2(1H)-THIONES AS INHIBITORS OF SODIUM IODIDE SYMPORTER SLC40A1, SLC5A11, SLC20A1 F2RL1 2193/4885ALDH1A1 583/4885CNR1 1248/4885

“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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