SCHEMBL13655014

SCHEMBL13655014

C=C(N[C@H](C(=O)NO)[C@@H](C)O)c1ccc(C#Cc2ccc(NC(=O)CNCc3cccc(Cl)c3)cc2)cc1

nearest known ligand 0.45

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
HDAC1 Q13547 1/20 0.40
MEN1 O00255 1/20 0.38
ALDH1A1 P00352 1/20 0.38
KMT2A Q03164 1/20 0.38
F7 P08709 1/20 0.38

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
SCHEMBL13659445 0.93 HDAC1 (0.41) HDAC1MEN1ALDH1A1KMT2AF7
SCHEMBL399708 0.92 HDAC1 (0.45) HDAC1
SCHEMBL13655022 0.91 KDM4E (0.38) ALDH1A1
SCHEMBL13655011 0.90 ANPEP (0.40) ALDH1A1
SCHEMBL13655015 0.89 MAPT (0.47) HDAC1
SCHEMBL13655023 0.88 PTGES (0.39) MEN1KMT2A
SCHEMBL13655038 0.87 HTT (0.39) MEN1KMT2A
SCHEMBL13655024 0.86 NAMPT (0.41) MEN1KMT2A
SCHEMBL13655042 0.85 LMNA (0.39)
SCHEMBL13655028 0.85 LMNA (0.44) ALDH1A1KMT2A

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-20090247506-A1 Antibacterial agents CHIRON CORPORATION 2009-10-01 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-20090247506-A1 Antibacterial agents MRPL21, SI, PGLS HDAC1 824/4885MEN1 2414/4885ALDH1A1 782/4885

“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.