SCHEMBL10007101

SCHEMBL10007101

Cn1c(=O)n(C(=O)N2CCCC2)c2nc(-c3ccccc3)ncc21

nearest known ligand 0.48

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
TSPO P30536 1/20 0.48
HPGD P15428 2/20 0.45
CNR1 P21554 1/20 0.40
TSHR P16473 1/20 0.39
MAPK1 P28482 1/20 0.39
PTK2 Q05397 1/20 0.39
NPC1 O15118 1/20 0.39
TP53 P04637 1/20 0.39
RAB9A P51151 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
HTT P42858 1/20 0.38
MEN1 O00255 1/20 0.38
KMT2A Q03164 1/20 0.38
GRIN2B Q13224 1/20 0.38

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
SCHEMBL10006571 0.98 TSPO (0.47) TSPOHPGDCNR1TSHRMAPK1
SCHEMBL10267724 0.98 TSPO (0.48) TSPOHPGDCNR1TSHRMAPK1
SCHEMBL10007263 0.91 HPGD (0.47) TSPOHPGDCNR1TSHRMAPK1
SCHEMBL10261602 0.90 HPGD (0.40) TSPOHPGDPTK2
SCHEMBL10006853 0.90 CNR1 (0.41) TSPOHPGDCNR1GRIN2B
SCHEMBL10006720 0.90 HPGD (0.49) TSPOHPGDCNR1TSHRMAPK1
SCHEMBL10261115 0.89 HPGD (0.41) TSPOHPGDTSHR
SCHEMBL10007221 0.89 HDAC1 (0.47) TSPONPC1RAB9ASMN1; SMN2MEN1
SCHEMBL10007507 0.89 HPGD (0.45) TSPOHPGDCNR1TSHRMAPK1
SCHEMBL10006980 0.88 GRIN2B (0.42) TSPOHPGDNPC1TP53RAB9A

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
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
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
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 TSPO 1233/4885HPGD 170/4885CNR1 66/4885

“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.