SCHEMBL26280835

SCHEMBL26280835

CC(C)=NNc1cnc2c(c1)n(C(C)C)c(=O)n2C1CC1

nearest known ligand 0.36

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ PRKDC P78527 8/20 0.36
▸ TNF P01375 1/20 0.33
▸ LITAF Q99732 1/20 0.33
▸ PIK3CA P42336 4/20 0.31
▸ MTOR P42345 2/20 0.31
▸ PDE4B Q07343 1/20 0.31
▸ MAPT P10636 1/20 0.30

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
SCHEMBL24130516 0.87 ALDH1A1 (0.34) PRKDCTNFLITAFPIK3CAMAPT
SCHEMBL26280780 0.85 PRKDC (0.43) PRKDCPIK3CAMTOR
SCHEMBL26280370 0.85 MAPT (0.34) MAPT
SCHEMBL26280805 0.84 EEF2K (0.40) PRKDCTNFLITAFPDE4B
SCHEMBL26280634 0.83 MAPT (0.41) MAPT
SCHEMBL26280725 0.82 TNF (0.35) TNFLITAFMAPT
SCHEMBL26280575 0.81 SLC6A2 (0.37) PRKDCPIK3CAMTOR
SCHEMBL26280865 0.80 MAPT (0.40) MAPT
SCHEMBL26280884 0.77 TNF (0.35) TNFLITAFPDE4BMAPT
SCHEMBL25436149 0.76 PRKDC (0.38) PRKDCTNFLITAFPIK3CAMTOR

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 1525/4885TNF 4793/4885LITAF 2991/4885

“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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