SCHEMBL5765288

SCHEMBL5765288

CC1=C(C(=O)OCCc2cccc(Cl)c2)C(CO)NC(=S)N1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 7/20 0.44
CACNA1F O60840 1/20 0.43
CACNA1D Q01668 1/20 0.43
CACNA1S Q13698 1/20 0.43
CACNA1C Q13936 1/20 0.43
ALOX12 P18054 4/20 0.43
LMNA P02545 4/20 0.43
MAPT P10636 3/20 0.43
KMT2A Q03164 3/20 0.43
MEN1 O00255 2/20 0.43
DHFR P00374 1/20 0.42
CA1 P00915 3/20 0.42
CA2 P00918 3/20 0.42
SMN1; SMN2 Q16637 2/20 0.41
HTT P42858 2/20 0.41
TP53 P04637 1/20 0.41
HSP90AA1 P07900 1/20 0.41
NPSR1 Q6W5P4 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
CACNA1B Q00975 1/20 0.41

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
SCHEMBL5794068 0.92 ALDH1A1 (0.42) ALDH1A1CACNA1FCACNA1DCACNA1SCACNA1C
SCHEMBL5767392 0.90 CA1 (0.42) ALDH1A1CACNA1FCACNA1DCACNA1SCACNA1C
SCHEMBL5767258 0.89 ALDH1A1 (0.47) ALDH1A1ALOX12LMNAMAPTKMT2A
SCHEMBL5764699 0.88 CACNA1F (0.43) ALDH1A1CACNA1FCACNA1DCACNA1SCACNA1C
SCHEMBL5765826 0.88 ALDH1A1 (0.47) ALDH1A1ALOX12LMNAKMT2ADHFR
SCHEMBL5767639 0.87 ALDH1A1 (0.44) ALDH1A1ALOX12LMNAMAPTKMT2A
SCHEMBL5765027 0.86 ALDH1A1 (0.43) ALDH1A1ALOX12LMNAMAPTKMT2A
SCHEMBL5764738 0.85 ALDH1A1 (0.44) ALDH1A1ALOX12LMNAMAPTKMT2A
SCHEMBL5793380 0.85 ALDH1A1 (0.44) ALDH1A1CACNA1FCACNA1DCACNA1SCACNA1C
SCHEMBL5763764 0.85 CACNA1F (0.46) ALDH1A1CACNA1FCACNA1DCACNA1SCACNA1C

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-20060116390-A1 Hepatitis c virus inhibitors LG LIFE SCIENCES LTD. (KR) 2006-06-01 US disclosed
EP-1633725-A1 HEPATITIS C VIRUS INHIBITORS LG Life Sciences Ltd. (KR) 2006-03-15 EP disclosed
WO-2004111013-A1 HEPATITIS C VIRUS INHIBITORS LG LIFE SCIENCES LTD. (KR) 2004-12-23 WO 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-20060116390-A1 Hepatitis c virus inhibitors HAVCR2, LIPC, FABP1 ALDH1A1 1058/4885CACNA1F 4796/4885CACNA1D 4868/4885

“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.