SCHEMBL10006525

SCHEMBL10006525

CCn1c(=O)n(C(=O)N2CCC2)c2nc(CCc3ccc(F)cc3)ncc21

nearest known ligand 0.36

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ GRIN2B Q13224 5/20 0.36
▸ ADORA1 P30542 2/20 0.35
▸ KMT2A Q03164 2/20 0.35
▸ MAOB P27338 1/20 0.35
▸ ADORA2A P29274 1/20 0.35
▸ GRIN1 Q05586 2/20 0.34
▸ L3MBTL1 Q9Y468 1/20 0.34
▸ HRH3 Q9Y5N1 1/20 0.33
▸ MEN1 O00255 1/20 0.33
▸ KDM4E B2RXH2 1/20 0.32
▸ SMN1; SMN2 Q16637 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
SCHEMBL10006357 0.88 GRIN2B (0.37) GRIN2BMAOBGRIN1SMN1; SMN2
SCHEMBL10006583 0.86 ALDH1A1 (0.36) GRIN2BMAOBGRIN1SMN1; SMN2
SCHEMBL10007280 0.85 TSHR (0.35) GRIN2BADORA1KMT2AMAOBADORA2A
SCHEMBL10006348 0.83 CYP3A4 (0.38) KMT2AL3MBTL1MEN1KDM4ESMN1; SMN2
SCHEMBL10007296 0.78 GRIN2B (0.43) GRIN2BGRIN1
SCHEMBL10006678 0.78 GRIN2B (0.37) GRIN2BMAOBADORA2AGRIN1
SCHEMBL10261397 0.78 TSHR (0.41) KMT2AADORA2AMEN1SMN1; SMN2
SCHEMBL10006797 0.77 ATM (0.39) GRIN2BKMT2AMAOBGRIN1
SCHEMBL10261255 0.77 PREP (0.36) GRIN2BKMT2AHRH3MEN1KDM4E
SCHEMBL10007381 0.77 TSHR (0.38) GRIN2BGRIN1SMN1; SMN2

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 GRIN2B 635/4885ADORA1 32/4885KMT2A 769/4885

“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.

Send feedback