SCHEMBL13655189

SCHEMBL13655189

CC[C@H](NC(=O)c1ccc(C#Cc2ccc(NC(=O)CN(C)C3CC3)cc2)cc1)C(=O)NO

nearest known ligand 0.47

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.43
POLB P06746 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
L3MBTL1 Q9Y468 2/20 0.42
MEN1 O00255 2/20 0.41
KMT2A Q03164 2/20 0.41
TDP1 Q9NUW8 1/20 0.40

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
SCHEMBL461859 0.91 ALDH1A1 (0.42) ALDH1A1POLBSMN1; SMN2L3MBTL1MEN1
SCHEMBL13659701 0.91 ALDH1A1 (0.45) ALDH1A1POLBSMN1; SMN2L3MBTL1MEN1
SCHEMBL460072 0.88 ALDH1A1 (0.48) ALDH1A1POLBSMN1; SMN2L3MBTL1MEN1
SCHEMBL400493 0.86 ALDH1A1 (0.42) ALDH1A1POLBSMN1; SMN2MEN1KMT2A
SCHEMBL437259 0.84 ALDH1A1 (0.46) ALDH1A1POLBSMN1; SMN2L3MBTL1MEN1
SCHEMBL10285906 0.82 ALDH1A1 (0.44) ALDH1A1POLBSMN1; SMN2L3MBTL1MEN1
SCHEMBL402870 0.82 ALDH1A1 (0.48) ALDH1A1POLBSMN1; SMN2L3MBTL1MEN1
SCHEMBL1095970 0.79 ALDH1A1 (0.46) ALDH1A1POLBSMN1; SMN2L3MBTL1MEN1
SCHEMBL460940 0.79 MAPT (0.42)
SCHEMBL1109170 0.79 ALDH1A1 (0.50) ALDH1A1POLBSMN1; SMN2L3MBTL1MEN1

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 ALDH1A1 782/4885POLB 640/4885SMN1; SMN2 2296/4885

“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.