SCHEMBL19929706

SCHEMBL19929706

C#CCOCC#CC(C)(O)C#CC

nearest known ligand 0.33

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 1/20 0.33
▸ ALDH1A1 P00352 1/20 0.33
▸ KMT2A Q03164 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
SCHEMBL19929719 0.75 MAPT (0.42) MEN1ALDH1A1KMT2A
SCHEMBL13259193 0.73 — —
SCHEMBL19929708 0.72 ALDH1A1 (0.33) MEN1ALDH1A1KMT2A
SCHEMBL10439421 0.71 MEN1 (0.45) MEN1ALDH1A1KMT2A
SCHEMBL10439424 0.67 MEN1 (0.48) MEN1ALDH1A1KMT2A
SCHEMBL27741471 0.64 TSHR (0.42) MEN1ALDH1A1KMT2A
SCHEMBL39635 0.64 — —
SCHEMBL3221908 0.63 MEN1 (0.38) MEN1ALDH1A1KMT2A
Alcohol SCHEMBL28661859 0.62 ALDH1A1 (0.40) MEN1ALDH1A1KMT2A
SCHEMBL6734112 0.62 — —

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-20180065908-A1 CHAIN MULTIYNE COMPOUND, PREPARATION METHOD AND APPLICATION THEREOF XIAMEN UNIVERSITY (CN) 2018-03-08 — — 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-20180065908-A1 CHAIN MULTIYNE COMPOUND, PREPARATION METHOD AND APPLICATION THEREOF SQLE, COASY, MCCC2 MEN1 289/4885ALDH1A1 761/4885KMT2A 1920/4885

“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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