SCHEMBL21883533

SCHEMBL21883533

C[Si](C)(C)CCOCn1cnc2c(OCc3ccccc3)nc(Cl)nc21

nearest known ligand 0.46

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
DAPK1 P53355 1/20 0.46
YTHDC1 Q96MU7 6/20 0.45
ADORA2A P29274 1/20 0.42
MGMT P16455 1/20 0.40
NT5E P21589 1/20 0.40
DGAT1 O75907 2/20 0.40
CDK1 P06493 2/20 0.37
CNR2 P34972 1/20 0.37
PIN1 Q13526 1/20 0.36
PDE2A O00408 1/20 0.35

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
SCHEMBL30496465 1.00 DAPK1 (0.46) DAPK1YTHDC1ADORA2AMGMTNT5E
SCHEMBL20555334 0.84 PNP (0.36) YTHDC1DGAT1
SCHEMBL20555316 0.83 YTHDC1 (0.38) YTHDC1DGAT1
SCHEMBL12537185 0.82 DGAT1 (0.40) YTHDC1ADORA2ADGAT1
SCHEMBL3267555 0.80 P2RX7 (0.43) YTHDC1DGAT1
SCHEMBL30496451 0.80 P2RX7 (0.43) YTHDC1DGAT1
SCHEMBL10577131 0.79 DAPK1 (0.45) DAPK1YTHDC1ADORA2AMGMTNT5E
SCHEMBL29864160 0.79 DGAT1 (0.40) DGAT1PIN1
SCHEMBL10579865 0.79 DAPK1 (0.46) DAPK1YTHDC1ADORA2AMGMTNT5E
SCHEMBL4112973 0.78 DGAT1 (0.38) YTHDC1ADORA2ADGAT1CNR2

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
US-12157739-B2 Hypoxanthine compounds KISSEI PHARMACEUTICAL CO., LTD. (JP) 2024-12-03 US disclosed
US-20210214357-A1 HYPOXANTHINE COMPOUNDS KISSEI PHARMACEUTICAL CO., LTD. (JP) 2021-07-15 US disclosed
US-20210214357-A1 HYPOXANTHINE COMPOUNDS KISSEI PHARMACEUTICAL CO., LTD. (JP) 2021-07-15 US disclosed
EP-3819299-A1 HYPOXANTHINE COMPOUND KISSEI PHARMACEUTICAL CO., LTD. (JP) 2021-05-12 EP disclosed
EP-3819299-A1 HYPOXANTHINE COMPOUND KISSEI PHARMACEUTICAL CO., LTD. (JP) 2021-05-12 EP disclosed
WO-2020054825-A1 HYPOXANTHINE COMPOUND キッセイ薬品工業株式会社 2020-03-19 WO 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 (2 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-12157739-B2 Hypoxanthine compounds HPRT1, APRT, IMPDH1 DAPK1 4479/4885YTHDC1 651/4885ADORA2A 1186/4885
US-20210214357-A1 HYPOXANTHINE COMPOUNDS HPRT1, DHPS, PAH DAPK1 4081/4885YTHDC1 611/4885ADORA2A 2291/4885

“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.