SCHEMBL5070271

SCHEMBL5070271

COC(=O)c1ccc(OC[C@@H](CC(C)C)NC(=O)OC(C)(C)C)cc1

nearest known ligand 0.55

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
AAK1 Q2M2I8 7/20 0.55
GAA P10253 1/20 0.49
TSHR P16473 1/20 0.49
MAPT P10636 2/20 0.47
ALDH1A1 P00352 1/20 0.43
LMNA P02545 1/20 0.43
RAB9A P51151 1/20 0.43
HRH2 P25021 2/20 0.42
HRH1 P35367 2/20 0.42
TAS1R3 Q7RTX0 1/20 0.42
TAS1R1 Q7RTX1 1/20 0.42

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
SCHEMBL5070267 1.00 AAK1 (0.55) AAK1GAATSHRMAPTALDH1A1
SCHEMBL9110433 0.85 MAPT (0.51) GAATSHRMAPTALDH1A1LMNA
SCHEMBL19834511 0.85 MAPT (0.51) GAATSHRMAPTALDH1A1LMNA
SCHEMBL14175255 0.76 AAK1 (0.53) AAK1TAS1R3TAS1R1
SCHEMBL14923598 0.76 AAK1 (0.53) AAK1TAS1R3TAS1R1
SCHEMBL3375872 0.76 AAK1 (0.53) AAK1TAS1R3TAS1R1
SCHEMBL20765902 0.76 MAPT (0.68) GAATSHRMAPTALDH1A1LMNA
SCHEMBL15565779 0.75 NPC1 (0.52) TSHRMAPTALDH1A1LMNARAB9A
SCHEMBL15565776 0.75 NPC1 (0.52) TSHRMAPTALDH1A1LMNARAB9A
SCHEMBL445487 0.75 CA1 (0.64) TSHRMAPTRAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7384952-B2 Pyrazolopyrimidine compound and a process for preparing the same MITSUBISHI TANABE PHARMA CORPORATION (JP) 2008-06-10 US disclosed
EP-1857459-A2 Pyrazolopyrimidine compound and a process for preparing the same TANABE SEIYAKU CO., LTD. (JP) 2007-11-21 EP disclosed
US-20060135525-A1 Pyrazolopyrimidine compound and a process for preparing the same MITSUBISHI TANABE PHARMA CORPORATION (JP) 2006-06-22 US disclosed
EP-1585481-A2 PYRAZOLOPYRIMIDINE COMPOUND AND PROCESS FOR PREPARING THE SAME TANABE SEIYAKU CO., LTD. (JP) 2005-10-19 EP disclosed
WO-2004064721-A2 A PYRAZOLOPYRIMIDINE COMPOUND AND A PROCESS FOR PREPARING THE SAME TANABE SEIYAKU CO., LTD. (JP) 2004-08-05 WO 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-20060135525-A1 Pyrazolopyrimidine compound and a process for preparing the same KCNJ2, KCNN2, KCNH2 AAK1 1347/4885GAA 3995/4885TSHR 3098/4885

“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.