SCHEMBL1014528

SCHEMBL1014528

COc1cc(CN2CCOCC2)ccc1C(=O)N(C)OC

nearest known ligand 0.64

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
HTT P42858 2/20 0.54
ALDH1A1 P00352 1/20 0.48
SMN1; SMN2 Q16637 1/20 0.48
KMT2A Q03164 2/20 0.47
MEN1 O00255 1/20 0.47
PDE4B Q07343 2/20 0.46
LMNA P02545 1/20 0.46
CHEK1 O14757 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
SCHEMBL1011847 0.87 MCHR1 (0.48) HTTSMN1; SMN2KMT2ALMNA
SCHEMBL12858371 0.85 TSHR (0.46) HTTALDH1A1SMN1; SMN2KMT2ALMNA
SCHEMBL1014420 0.84 HTT (0.60) HTTALDH1A1SMN1; SMN2KMT2APDE4B
SCHEMBL1013959 0.83 HTT (0.59) HTTALDH1A1SMN1; SMN2KMT2AMEN1
SCHEMBL1014491 0.80 HIF1A (0.61) SMN1; SMN2KMT2ALMNA
SCHEMBL1014092 0.79 ABL1 (0.50) HTTALDH1A1SMN1; SMN2KMT2ALMNA
SCHEMBL1014530 0.77 MAPT (0.51) HTTALDH1A1SMN1; SMN2KMT2AMEN1
SCHEMBL16884088 0.77 HTT (0.76) HTTALDH1A1SMN1; SMN2KMT2AMEN1
SCHEMBL4145433 0.76 HTT (0.66) HTTALDH1A1SMN1; SMN2PDE4BLMNA
SCHEMBL25062318 0.76 HTT (0.63) HTTALDH1A1SMN1; SMN2KMT2AMEN1

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-20110034466-A1 NOVEL FIVE-MEMBERED RING COMPOUND DAINIPPON SUMITOMO PHARMA CO., LTD. (JP) 2011-02-10 US disclosed
EP-2272835-A1 NOVEL FIVE-MEMBERED RING COMPOUND Dainippon Sumitomo Pharma Co., Ltd. (JP) 2011-01-12 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-20110034466-A1 NOVEL FIVE-MEMBERED RING COMPOUND CCL11, CCR1, CCR10 HTT 4437/4885ALDH1A1 2564/4885SMN1; SMN2 2809/4885

“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.