SCHEMBL5795474

SCHEMBL5795474

CC1=C(C(=O)OCCc2cc(F)cc(F)c2)C(CF)NC(=S)N1

nearest known ligand 0.42

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.42
GAA P10253 1/20 0.42
CA1 P00915 4/20 0.42
CA2 P00918 4/20 0.42
ALDH1A1 P00352 9/20 0.41
DHFR P00374 3/20 0.40
SMN1; SMN2 Q16637 2/20 0.39
ADORA2B P29275 4/20 0.38
POLB P06746 2/20 0.38
KMT2A Q03164 2/20 0.38
TP53 P04637 1/20 0.37
HSP90AA1 P07900 1/20 0.37
MAPT P10636 1/20 0.37
ALOX12 P18054 1/20 0.37
HTT P42858 1/20 0.37
NPSR1 Q6W5P4 1/20 0.37
L3MBTL1 Q9Y468 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
SCHEMBL5765306 0.91 ALDH1A1 (0.43) LMNAGAACA1CA2ALDH1A1
SCHEMBL5911424 0.89 CA1 (0.44) LMNAGAACA1CA2ALDH1A1
SCHEMBL5767090 0.88 ALDH1A1 (0.45) LMNAGAACA1CA2ALDH1A1
SCHEMBL5795958 0.86 CA1 (0.42) LMNAGAACA1CA2ALDH1A1
SCHEMBL5766855 0.85 DHFR (0.51) LMNACA1CA2ALDH1A1DHFR
SCHEMBL5911256 0.83 LMNA (0.41) LMNAGAACA1CA2ALDH1A1
SCHEMBL5767123 0.82 LMNA (0.45) LMNAGAACA1CA2ALDH1A1
SCHEMBL5766647 0.82 CA1 (0.43) LMNAGAACA1CA2ALDH1A1
SCHEMBL5794068 0.82 ALDH1A1 (0.42) LMNACA1CA2ALDH1A1DHFR
SCHEMBL5911660 0.81 ALDH1A1 (0.52) LMNAGAACA1CA2ALDH1A1

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 LMNA 726/4885GAA 200/4885CA1 4060/4885

“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.