SCHEMBL10006743

SCHEMBL10006743

CN(C)C(=O)n1c(=O)n(C)c2cnc(CCO)nc21

nearest known ligand 0.37

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ USP1 O94782 14/20 0.37
▸ TSPO P30536 1/20 0.36
▸ ALDH1A1 P00352 1/20 0.32
▸ KMT2A Q03164 1/20 0.32

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
SCHEMBL10267773 0.85 DAGLA (0.46) USP1TSPOALDH1A1
SCHEMBL10006652 0.84 USP1 (0.39) USP1TSPO
SCHEMBL10007126 0.83 GRIN2B (0.41) USP1TSPOALDH1A1KMT2A
SCHEMBL10261859 0.83 DAGLA (0.47) USP1TSPOALDH1A1KMT2A
SCHEMBL10008025 0.83 USP1 (0.40) USP1TSPOALDH1A1KMT2A
SCHEMBL10261340 0.83 DAGLA (0.45) USP1TSPOALDH1A1KMT2A
SCHEMBL10261033 0.82 USP1 (0.43) USP1TSPOALDH1A1
SCHEMBL10261393 0.82 USP1 (0.35) USP1TSPOALDH1A1
SCHEMBL10261864 0.81 USP1 (0.35) USP1TSPOALDH1A1
SCHEMBL10006703 0.81 DUT (0.33) USP1

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 USP1 1070/4885TSPO 1233/4885ALDH1A1 50/4885

“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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