SCHEMBL10267777

SCHEMBL10267777

CCN(C)C(=O)n1c(=O)n(C)c2cnc(CCc3ccccc3)nc21

nearest known ligand 0.43

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ TSPO P30536 1/20 0.43
▸ DAGLA Q9Y4D2 1/20 0.38
▸ ALDH1A1 P00352 2/20 0.38
▸ TSHR P16473 2/20 0.38
▸ NPC1 O15118 1/20 0.38
▸ RAB9A P51151 1/20 0.38
▸ SMN1; SMN2 Q16637 1/20 0.38
▸ MEN1 O00255 1/20 0.37
▸ KMT2A Q03164 1/20 0.37
▸ USP1 O94782 1/20 0.36
▸ PIN1 Q13526 1/20 0.36
▸ CYP1A2 P05177 1/20 0.36
▸ CYP3A4 P08684 1/20 0.36
▸ CYP2C9 P11712 1/20 0.36
▸ CYP2C19 P33261 1/20 0.36
▸ CNOT7 Q9UIV1 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
SCHEMBL10267773 0.90 DAGLA (0.46) TSPODAGLAALDH1A1TSHRUSP1
SCHEMBL10261859 0.84 DAGLA (0.47) TSPODAGLAALDH1A1TSHRMEN1
SCHEMBL10261340 0.84 DAGLA (0.45) TSPODAGLAALDH1A1TSHRMEN1
SCHEMBL10006781 0.82 TSPO (0.40) TSPOALDH1A1SMN1; SMN2MEN1KMT2A
SCHEMBL10261156 0.82 TSPO (0.57) TSPOALDH1A1SMN1; SMN2MEN1KMT2A
SCHEMBL10006652 0.81 USP1 (0.39) TSPODAGLAUSP1
SCHEMBL10261371 0.81 TSPO (0.44) TSPODAGLAALDH1A1KMT2AUSP1
SCHEMBL10008025 0.80 USP1 (0.40) TSPODAGLAALDH1A1TSHRMEN1
SCHEMBL10261397 0.79 TSHR (0.41) TSPOALDH1A1TSHRNPC1SMN1; SMN2
SCHEMBL10006624 0.79 TSHR (0.43) TSPOALDH1A1TSHRNPC1MEN1

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8735406-B2 8-oxodihydropurine derivative DAINIPPON SUMITOMO PHARMA CO., LTD. (JP) 2014-05-27 — — 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 1233/4885DAGLA 1038/4885ALDH1A1 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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