SCHEMBL6950171

SCHEMBL6950171

CCNC(=O)N1CC1C#N

nearest known ligand 0.44

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ KMT2A Q03164 1/20 0.44
▸ DPP4 P27487 15/20 0.43
▸ MCL1 Q07820 1/20 0.38
▸ HTT P42858 1/20 0.38
▸ DPP8 Q6V1X1 1/20 0.36
▸ DPP9 Q86TI2 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
SCHEMBL11192313 0.82 DPP4 (0.49) DPP4
SCHEMBL6950828 0.79 GAA (0.41) DPP4DPP8DPP9
SCHEMBL11380419 0.77 DPP4 (0.37) DPP4DPP8DPP9
SCHEMBL11379024 0.76 DPP4 (0.37) DPP4DPP8DPP9
SCHEMBL11376697 0.76 DPP4 (0.36) DPP4DPP8DPP9
SCHEMBL11374506 0.76 PREP (0.37) DPP4DPP8DPP9
SCHEMBL11372100 0.75 ALDH1A1 (0.39) KMT2ADPP4DPP8DPP9
SCHEMBL11377773 0.75 — —
SCHEMBL11386347 0.74 PREP (0.36) DPP4DPP8DPP9
Dimethylamine SCHEMBL11372839 0.73 PREP (0.35) DPP4DPP8DPP9

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
EP-1027041-B1 NOVEL CYANOAZIRIDINES FOR TREATING CANCER AMPLIMED INC (US) 2003-10-22 — — EP disclosed
US-20030129222-A1 Administering to a cancer patient a therapeutically effective amount of imexon or derivative in combination with one or more lipids to treat the cancer VALLEY VENTURES III, L.P. 2003-07-10 — — US disclosed
US-6297230-B1 N-CARBAMOYL-SUBSTITUTED AMPLIMED, INC. 2001-10-02 — — US disclosed
EP-1027041-A4 NOVEL CYANOAZIRIDINES FOR TREATING CANCER UNIV ARIZONA (US) 2001-06-13 — — EP disclosed
EP-1027041-A1 NOVEL CYANOAZIRIDINES FOR TREATING CANCER THE ARIZONA BOARD OF REGENTS, ON BEHALF OF THE UNIVERSITY OF ARIZONA (US) 2000-08-16 — — EP disclosed
WO-1999000120-A1 NOVEL CYANOAZIRIDINES FOR TREATING CANCER ARIZONA BOARD OF REGENTS, UNIVERSITY OF ARIZONA (US) 1999-01-07 — — 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 (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-20030129222-A1 Administering to a cancer patient a therapeutically effective amount of imexon or derivative in combination with one or more lipids to treat the cancer ABHD16A, PNLIP, LIPA KMT2A 3657/4885DPP4 3112/4885MCL1 21/4885

“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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