SCHEMBL5070263

SCHEMBL5070263

CCOc1cccc(Cn2ncc3c(N4CCN(C(=O)[C@H]5CC[C@H](N6CCCC6)CC5)CC4)ncnc32)c1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 2/20 0.52
▸ KMT2A Q03164 2/20 0.52
▸ PKM P14618 3/20 0.48
▸ ALDH1A1 P00352 3/20 0.48
▸ MAPK1 P28482 4/20 0.45
▸ GPR55 Q9Y2T6 2/20 0.45
▸ MTNR1B P49286 1/20 0.44
▸ LMNA P02545 5/20 0.43
▸ HTT P42858 5/20 0.43
▸ GAA P10253 1/20 0.43
▸ SMN1; SMN2 Q16637 2/20 0.42
▸ NPC1 O15118 1/20 0.42
▸ HRH3 Q9Y5N1 1/20 0.42
▸ KDM4E B2RXH2 2/20 0.42
▸ L3MBTL1 Q9Y468 1/20 0.41
▸ HPGD P15428 1/20 0.41
▸ ALOX15 P16050 1/20 0.41
▸ TSHR P16473 1/20 0.41
▸ HSD17B10 Q99714 1/20 0.41
▸ GPR35 Q9HC97 1/20 0.41

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
SCHEMBL5070266 1.00 MEN1 (0.52) MEN1KMT2APKMALDH1A1MAPK1
SCHEMBL5068385 0.99 MEN1 (0.51) MEN1KMT2APKMALDH1A1MAPK1
SCHEMBL5068387 0.99 MEN1 (0.51) MEN1KMT2APKMALDH1A1MAPK1
Hydrochloric Acid SCHEMBL5065504 0.98 MEN1 (0.51) MEN1KMT2APKMALDH1A1MAPK1
Hydrochloric Acid SCHEMBL5065509 0.98 MEN1 (0.51) MEN1KMT2APKMALDH1A1MAPK1
SCHEMBL5068503 0.94 KMT2A (0.51) MEN1KMT2APKMALDH1A1MAPK1
SCHEMBL5065469 0.94 KMT2A (0.51) MEN1KMT2APKMALDH1A1MAPK1
SCHEMBL5068507 0.94 KMT2A (0.51) MEN1KMT2APKMALDH1A1MAPK1
SCHEMBL5065470 0.94 KMT2A (0.51) MEN1KMT2APKMALDH1A1MAPK1
SCHEMBL5068382 0.93 KMT2A (0.48) MEN1KMT2APKMALDH1A1MAPK1

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 6 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 claimed
EP-1857459-A2 Pyrazolopyrimidine compound and a process for preparing the same TANABE SEIYAKU CO., LTD. (JP) 2007-11-21 — — EP claimed
US-20060135525-A1 Pyrazolopyrimidine compound and a process for preparing the same MITSUBISHI TANABE PHARMA CORPORATION (JP) 2006-06-22 — — US claimed
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

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 MEN1 2842/4885KMT2A 638/4885PKM 332/4885

“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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