SCHEMBL4894071

SCHEMBL4894071

CC(=O)NC(C)C(=O)Nc1ccc(Cl)cc1C(=O)N1C[C@H](C)C[C@H](C)C1

nearest known ligand 0.46

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.46
NPSR1 Q6W5P4 2/20 0.46
KDM4E B2RXH2 3/20 0.44
HSD17B10 Q99714 1/20 0.44
L3MBTL1 Q9Y468 1/20 0.41
CCKBR P32239 1/20 0.41
GAA P10253 2/20 0.38
LMNA P02545 2/20 0.38
TP53 P04637 1/20 0.38
MASP2 O00187 1/20 0.38
ABL1 P00519 1/20 0.37
MEN1 O00255 1/20 0.37
KMT2A Q03164 1/20 0.37
RAB9A P51151 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.37

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
SCHEMBL4896900 0.87 L3MBTL1 (0.41) ALDH1A1NPSR1KDM4EL3MBTL1GAA
SCHEMBL4884281 0.87 KDM4E (0.44) ALDH1A1NPSR1KDM4EL3MBTL1GAA
SCHEMBL14112904 0.87 L3MBTL1 (0.41) ALDH1A1NPSR1KDM4EL3MBTL1GAA
SCHEMBL4886951 0.84 ALDH1A1 (0.43) ALDH1A1NPSR1KDM4EHSD17B10L3MBTL1
SCHEMBL4886934 0.84 ALDH1A1 (0.43) ALDH1A1NPSR1KDM4EHSD17B10L3MBTL1
SCHEMBL14087763 0.83 ALDH1A1 (0.42) ALDH1A1NPSR1KDM4EHSD17B10L3MBTL1
SCHEMBL4883870 0.80 ALDH1A1 (0.48) ALDH1A1NPSR1KDM4EHSD17B10L3MBTL1
SCHEMBL4887010 0.79 ALDH1A1 (0.50) ALDH1A1NPSR1KDM4EHSD17B10L3MBTL1
SCHEMBL4887023 0.78 GABRP (0.51) ALDH1A1NPSR1KDM4EHSD17B10L3MBTL1
SCHEMBL14087779 0.76 ALDH1A1 (0.44) ALDH1A1NPSR1KDM4EHSD17B10L3MBTL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20080200512-A1 Hepatitis C virus polymerase inhibitors BLANEY JEFFREY MARK 2008-08-21 US disclosed
US-20080200512-A1 Hepatitis C virus polymerase inhibitors BLANEY JEFFREY MARK 2008-08-21 US disclosed
US-20080200512-A1 Hepatitis C virus polymerase inhibitors BLANEY JEFFREY MARK 2008-08-21 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-20080200512-A1 Hepatitis C virus polymerase inhibitors SSU72, POLR2H, POLR2E ALDH1A1 276/4885NPSR1 2465/4885KDM4E 2519/4885

“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.