SCHEMBL14878203

SCHEMBL14878203

CC#C/C(C)=N\OCC1CNCCN1

nearest known ligand 0.33

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
▸ LTA4H P09960 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
SCHEMBL9973611 0.82 LTA4H (0.31) LTA4H
SCHEMBL9973610 0.82 LTA4H (0.31) LTA4H
SCHEMBL6976925 0.81 LTA4H (0.37) LTA4H
SCHEMBL6979337 0.81 LTA4H (0.37) LTA4H
SCHEMBL14878202 0.81 CHRNB4 (0.35) —
SCHEMBL14878204 0.77 IRAK4 (0.31) —
SCHEMBL14878201 0.77 IRAK4 (0.31) —
SCHEMBL6976822 0.76 LTA4H (0.34) LTA4H
SCHEMBL6976618 0.75 — —
SCHEMBL15304778 0.74 HTR2A (0.39) —

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-20170197943-A1 PROCESS FOR PRODUCING ALKYNYLKETONE DERIVATIVE SHIONOGI & CO., LTD. (JP) 2017-07-13 — — US disclosed
US-8426589-B2 Process for production of quinazoline derivative SHIONOGI & CO., LTD. (JP) 2013-04-23 — — 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-20170197943-A1 PROCESS FOR PRODUCING ALKYNYLKETONE DERIVATIVE PDK4, PDK3, PDK2 LTA4H 2133/4885

“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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