SCHEMBL10006561

SCHEMBL10006561

CCN(C)C(=O)n1c(=O)n(C)c2nc(Cc3cccc(F)c3)ncc21

nearest known ligand 0.40

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ MAOA P21397 1/20 0.40
▸ MAOB P27338 1/20 0.40
▸ TP53 P04637 1/20 0.38
▸ GRIN1 Q05586 11/20 0.37
▸ GRIN2B Q13224 11/20 0.37
▸ LMNA P02545 2/20 0.37
▸ MAPT P10636 1/20 0.37
▸ HTR2C P28335 1/20 0.37
▸ HTR2B P41595 1/20 0.37
▸ PDE1A P54750 1/20 0.36
▸ PDE1B Q01064 1/20 0.36
▸ PDE1C Q14123 1/20 0.36
▸ ALDH1A1 P00352 1/20 0.36
▸ GLA P06280 1/20 0.36

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
SCHEMBL10007610 0.90 GRIN2B (0.41) MAOAMAOBGRIN1GRIN2BLMNA
SCHEMBL10006926 0.88 GAA (0.36) MAOAMAOBTP53GRIN1GRIN2B
SCHEMBL10006781 0.88 TSPO (0.40) MAOAMAOBALDH1A1
SCHEMBL10006747 0.87 MAOA (0.42) MAOAMAOBTP53LMNAMAPT
SCHEMBL10006851 0.83 TRPV1 (0.36) MAOBTP53GRIN1GRIN2BLMNA
SCHEMBL10006772 0.81 MAOA (0.40) MAOAMAOBGRIN1GRIN2BLMNA
SCHEMBL10007454 0.81 GABRG2 (0.38) MAOBTP53LMNAMAPTHTR2C
SCHEMBL10006847 0.77 MEN1 (0.35) GRIN1GRIN2BLMNAMAPTALDH1A1
SCHEMBL10007102 0.77 ALDH1A1 (0.36) TP53GRIN1GRIN2BMAPTALDH1A1
SCHEMBL10006794 0.76 HTR2C (0.39) MAOAMAOBGRIN1GRIN2BLMNA

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
EP-2476682-B1 8-OXODIHYDROPURINE DERIVATIVE SUMITOMO DAINIPPON PHARMA CO LTD (JP) 2017-04-26 — — EP disclosed
US-8735406-B2 8-oxodihydropurine derivative DAINIPPON SUMITOMO PHARMA CO., LTD. (JP) 2014-05-27 — — US disclosed
EP-2476682-A1 8-OXODIHYDROPURINE DERIVATIVE Dainippon Sumitomo Pharma Co., Ltd. (JP) 2012-07-18 — — EP disclosed
US-20120172347-A1 8-OXODIHYDROPURINE DERIVATIVE DAINIPPON SUMITOMO PHARMA CO., LTD. (JP) 2012-07-05 — — 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-20120172347-A1 8-OXODIHYDROPURINE DERIVATIVE FAAH, FAAH2, TPMT MAOA 17/4885MAOB 15/4885TP53 4787/4885

“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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