SCHEMBL5067600

SCHEMBL5067600

CCOC(=O)c1ccc(NCCCCN(C)C)nn1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ POLB P06746 3/20 0.42
▸ KMT2A Q03164 2/20 0.42
▸ RAD52 P43351 2/20 0.42
▸ UHRF1 Q96T88 1/20 0.42
▸ CYP1A2 P05177 3/20 0.42
▸ ACHE P22303 4/20 0.40
▸ LMNA P02545 2/20 0.40
▸ MAOA P21397 1/20 0.40
▸ CNR1 P21554 1/20 0.40
▸ DRD4 P21917 1/20 0.40
▸ HRH2 P25021 1/20 0.40
▸ HTR2A P28223 1/20 0.40
▸ HTR2C P28335 1/20 0.40
▸ MAPK1 P28482 1/20 0.40
▸ NTSR1 P30989 1/20 0.40
▸ HRH1 P35367 1/20 0.40
▸ DRD3 P35462 1/20 0.40
▸ SCN1A P35498 1/20 0.40
▸ HTR2B P41595 1/20 0.40
▸ SCN7A Q01118 1/20 0.40

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
SCHEMBL5067602 0.75 CYP1A2 (0.42) POLBKMT2ARAD52UHRF1CYP1A2
SCHEMBL4041873 0.75 CYP1A2 (0.50) POLBKMT2ACYP1A2LMNAMAOA
SCHEMBL5642066 0.74 CYP1A2 (0.64) POLBKMT2ACYP1A2LMNAMAOA
SCHEMBL6279336 0.72 TP53 (0.42) POLBKMT2ARAD52UHRF1CYP1A2
SCHEMBL7669717 0.69 TSHR (0.46) CYP1A2LMNAMAPK1RAB9AALDH1A1
SCHEMBL17984648 0.69 CYP1A2 (0.50) POLBKMT2ACYP1A2LMNAMAOA
SCHEMBL28911125 0.69 KMT2A (0.48) POLBKMT2ARAD52UHRF1CYP1A2
SCHEMBL6279338 0.68 CYP1A2 (0.38) POLBKMT2ARAD52UHRF1CYP1A2
SCHEMBL13197220 0.68 CYP1A2 (0.56) POLBKMT2ACYP1A2LMNAMAOA
SCHEMBL29524945 0.68 CYP1A2 (0.56) POLBKMT2ACYP1A2LMNAMAOA

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 3 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

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 POLB 2895/4885KMT2A 638/4885RAD52 4171/4885

“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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