SCHEMBL25436149

SCHEMBL25436149

CC(C)n1c(=O)n(C2CC2)c2ncc(N)cc21

nearest known ligand 0.38

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ PRKDC P78527 4/20 0.38
▸ PIK3CA P42336 10/20 0.36
▸ MTOR P42345 5/20 0.36
▸ PDE4B Q07343 2/20 0.36
▸ ATM Q13315 1/20 0.36
▸ ATR Q13535 1/20 0.36
▸ EEF2K O00418 1/20 0.36
▸ EEF2 P13639 1/20 0.36
▸ TNF P01375 1/20 0.35
▸ LITAF Q99732 1/20 0.35
▸ OPRD1 P41143 4/20 0.34
▸ KCNH2 Q12809 4/20 0.34
▸ ADORA2B P29275 1/20 0.33

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
SCHEMBL30349870 1.00 PRKDC (0.38) PRKDCPIK3CAMTORPDE4BATM
SCHEMBL25406092 0.82 PIK3CA (0.48) PRKDCPIK3CAMTORATMATR
SCHEMBL30349836 0.82 PIK3CA (0.48) PRKDCPIK3CAMTORATMATR
SCHEMBL30349801 0.81 EEF2K (0.48) PIK3CAPDE4BEEF2KEEF2TNF
SCHEMBL25404789 0.81 EEF2K (0.48) PIK3CAPDE4BEEF2KEEF2TNF
SCHEMBL25407722 0.81 ADORA2B (0.42) PIK3CAMTORPDE4BATMADORA2B
SCHEMBL30349636 0.81 ADORA2B (0.42) PIK3CAMTORPDE4BATMADORA2B
SCHEMBL25407320 0.80 HSD17B10 (0.46) ATMATRADORA2B
SCHEMBL30349854 0.80 PRKDC (0.38) PRKDCPIK3CAMTORTNFLITAF
SCHEMBL25406873 0.78 KDM4E (0.41) PDE4BEEF2KTNFLITAFADORA2B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230295095-A1 NOVEL FUSED-HETEROCYCLYL-CARBONOHYDRAZONOYL DICYANIDE COMPOUNDS AND USE THEREOF KOREA INSTITUTE OF SCIENCE AND TECHNOLOGY (KR) 2023-09-21 — — 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-20230295095-A1 NOVEL FUSED-HETEROCYCLYL-CARBONOHYDRAZONOYL DICYANIDE COMPOUNDS AND USE THEREOF CBR3, DBF4, DDT PRKDC 1525/4885PIK3CA 2545/4885MTOR 1775/4885

“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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