SCHEMBL5765826

SCHEMBL5765826

CC1=C(C(=O)OCCc2ccc(Cl)cc2)C(CO)NC(=S)N1

nearest known ligand 0.47

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.47
LMNA P02545 1/20 0.47
ALOX12 P18054 1/20 0.47
HTT P42858 1/20 0.47
KMT2A Q03164 1/20 0.47
DHFR P00374 1/20 0.45
CA1 P00915 2/20 0.44
CA2 P00918 2/20 0.44
SMN1; SMN2 Q16637 1/20 0.44
ABCC1 P33527 1/20 0.43
ADORA2B P29275 1/20 0.42
GUSB P08236 1/20 0.42

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
SCHEMBL5765665 0.91 CA1 (0.54) ALDH1A1LMNAALOX12HTTKMT2A
SCHEMBL5765692 0.89 ALDH1A1 (0.46) ALDH1A1LMNAALOX12HTTKMT2A
SCHEMBL5767639 0.88 ALDH1A1 (0.44) ALDH1A1LMNAALOX12HTTKMT2A
SCHEMBL5765288 0.88 ALDH1A1 (0.44) ALDH1A1LMNAALOX12HTTKMT2A
SCHEMBL5765027 0.87 ALDH1A1 (0.43) ALDH1A1LMNAALOX12HTTKMT2A
SCHEMBL5805050 0.87 ALDH1A1 (0.44) ALDH1A1LMNAALOX12HTTKMT2A
SCHEMBL5911348 0.87 ALDH1A1 (0.44) ALDH1A1LMNAALOX12HTTKMT2A
SCHEMBL5764738 0.86 ALDH1A1 (0.44) ALDH1A1LMNAALOX12HTTKMT2A
SCHEMBL5766870 0.86 DHFR (0.47) ALDH1A1LMNAALOX12KMT2ADHFR
SCHEMBL5821119 0.85 ALDH1A1 (0.43) ALDH1A1LMNAALOX12HTTKMT2A

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 1058/4885LMNA 726/4885ALOX12 1819/4885

“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.