SCHEMBL25406092

SCHEMBL25406092

Cn1c(=O)n(C2CC2)c2ncc(N)cc21

nearest known ligand 0.48

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ PIK3CA P42336 13/20 0.48
▸ MTOR P42345 9/20 0.48
▸ ATM Q13315 2/20 0.48
▸ ATR Q13535 2/20 0.48
▸ PRKDC P78527 12/20 0.46
▸ HSD17B10 Q99714 2/20 0.43
▸ HPGD P15428 1/20 0.43
▸ HTT P42858 1/20 0.43

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
SCHEMBL30349836 1.00 PIK3CA (0.48) PIK3CAMTORATMATRPRKDC
SCHEMBL30349801 0.82 EEF2K (0.48) PIK3CA
SCHEMBL30349870 0.82 PRKDC (0.38) PIK3CAMTORATMATRPRKDC
SCHEMBL25436149 0.82 PRKDC (0.38) PIK3CAMTORATMATRPRKDC
SCHEMBL25404789 0.82 EEF2K (0.48) PIK3CA
SCHEMBL25407471 0.81 HSD17B10 (0.62) HSD17B10HPGDHTT
SCHEMBL30349792 0.81 HSD17B10 (0.62) HSD17B10HPGDHTT
SCHEMBL30635120 0.79 PIK3CA (0.40) PIK3CAMTORATMATRPRKDC
SCHEMBL30349839 0.78 PIK3CA (0.48) PIK3CAMTORATMATRPRKDC
SCHEMBL12791613 0.77 HPGD (0.63) PIK3CAMTORPRKDCHSD17B10HPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12590066-B2 Fused-heterocyclyl-carbonohydrazonoyl dicyanide compounds and use thereof KOREA INSTITUTE OF SCIENCE AND TECHNOLOGY (KR) 2026-03-31 — — US disclosed
US-20230295095-A1 NOVEL FUSED-HETEROCYCLYL-CARBONOHYDRAZONOYL DICYANIDE COMPOUNDS AND USE THEREOF KOREA INSTITUTE OF SCIENCE AND TECHNOLOGY (KR) 2023-09-21 — — US disclosed
EP-4169905-A1 NOVEL FUSED HETEROCYCLIC CARBONOHYDRAZONOYL DICYANIDE COMPOUND AND USE THEREOF Korea Institute of Science and Technology (KR) 2023-04-26 — — EP disclosed
CN-115867277-A Novel fused heterocyclyl-carbohydrazone acyldinitrile compounds and use thereof 韩国科学技术研究院 2023-03-28 — — CN 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-12590066-B2 Fused-heterocyclyl-carbonohydrazonoyl dicyanide compounds and use thereof H4C1; H4C2; H4C3; H4C4; H4C5; H4C6; H4C8; H4C9; H4C11; H4C12; H4C13; H4C14; H4C15; H4C16, CBR1, CLIC1 PIK3CA 3863/4885MTOR 3666/4885ATM 4534/4885
US-20230295095-A1 NOVEL FUSED-HETEROCYCLYL-CARBONOHYDRAZONOYL DICYANIDE COMPOUNDS AND USE THEREOF CBR3, DBF4, DDT PIK3CA 2545/4885MTOR 1775/4885ATM 3142/4885

“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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