SCHEMBL17433363

SCHEMBL17433363

CN1CCN(CCC(C)(C)C)C(=O)C1

nearest known ligand 0.37

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ GAA P10253 1/20 0.37
▸ NPC1 O15118 1/20 0.33
▸ RAB9A P51151 1/20 0.33
▸ DAO P14920 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
SCHEMBL21000344 0.84 GAA (0.35) GAANPC1RAB9A
SCHEMBL22600072 0.81 BTK (0.33) DAO
SCHEMBL15425489 0.78 GAA (0.40) GAANPC1RAB9ADAO
SCHEMBL12311449 0.78 GAA (0.40) GAANPC1RAB9A
SCHEMBL22230513 0.78 GAA (0.40) GAANPC1RAB9A
SCHEMBL5501105 0.77 DAO (0.38) DAO
SCHEMBL14357416 0.76 GAA (0.39) GAANPC1RAB9A
SCHEMBL14447305 0.76 GAA (0.39) GAANPC1RAB9A
SCHEMBL7904697 0.75 P2RX7 (0.39) GAANPC1RAB9A
SCHEMBL9963861 0.74 PIK3CD (0.50) —

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9427480-B2 Duocarmycin ADCs for use in treatment of endometrial cancer SYNTHON BIOPHARMACEUTICALS B.V. (NL) 2016-08-30 — — US disclosed
US-20160008487-A1 DUOCARMYCIN ADCS FOR USE IN TREATMENT OF ENDOMETRIAL CANCER BYONDIS B.V. (NL) 2016-01-14 — — 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-20160008487-A1 DUOCARMYCIN ADCS FOR USE IN TREATMENT OF ENDOMETRIAL CANCER CD38, MKI67, ACR GAA 2247/4885NPC1 3619/4885RAB9A 2539/4885

“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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